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Profile: ChemBest is a contract research company focused on the discovery of new moleculars. ChemBest provides a wide range of high quality research chemicals and biochemicals including novel life-science reagents, reference compounds and Natural compounds for laboratory and scientific use,with on-time delivery at competitive pricing. Besides, We offer synthesis services of organic compounds for the pharmaceutical, drug discovery and biopharma industries and supplies chemicals including regular reagents, fine chemicals, and pharmaceutical intermediates and so on. The volume of our products ranges from milligrams to kilograms scale. Our Featured Categories include Cancer Research Reagents & Antineoplastic Agents, Stem Cell Research Reagents, Signaling Pathway Inhibitors,Bioactive Small Molecules & Small Molecule Libraries, Peptide Research Reagents, Bioactive Peptides, Natural Bioactive Compounds, Drug Impurities, Monoclonal Antibodies (MABs), Novel Life Science Reagents, Biological Reagents & Inhibitors& Compound Libraries. Our Services: Custom Synthesis of Pharmaceutical Intermediates, Peptides, Drug Impurities, Natural Compounds & Reference Compounds. Our customers come from pharmaceutical and biotech companies, universities, research institutions.Customer satisfaction is guaranteed.We are dedicated to providing scientists world-wide an easy access to the most innovative life science reagents, and to help them make more significant discoveries. If you have any suggestions, problems or complaints regarding our products or services please let us know. We always welcome your feedback and comments. Welcome to ChemBest Research Laboratories Limited, Enjoy your one-stop shopping now! Brefeldin A CAS No.:20350-15-6 Laduviglusib | CHIR-99021 CAS No.:252917-06-9 Y-27632 Dihydrochloride CAS No.:129830-38-2 RepSox (ALK5 Inhibitor II) CAS No.:446859-33-2 Nintedanib Ethanesulfonate Salt | BIBF 1120 CAS No.:656247-18-6 Streptozotocin | Streptozocin | Streptozocin CAS No.:18883-66-4

201 to 250 of 513 Products/Chemicals (Click for related suppliers)  Page: << Previous 50 Results 1 2 3 4 [5] 6 7 8 9 10 11 >> Next 50 Results
• Neflamapimod
IUPAC Name: 5-(2,6-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpyridazino[6,1-f]pyrimidin-6-one | CAS Registry Number: 209410-46-8
Synonyms: VX-745, CID3038525, 5-(2,6-Dichlorophenyl)-2-((2,4-difluorophenyl)thio)-6H-pyrimido(1,6-b)pyridazin-6-one, 6H-Pyrimido(1,6-b)pyridazin-6-one, 5-(2,6-dichlorophenyl)-2-((2,4-difluorophenyl)thio)-

Molecular Formula: C19H9Cl2F2N3OSMolecular Weight: 436.262066 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: VEPKQEUBKLEPRA-UHFFFAOYSA-N

• Nelarabine
IUPAC Name: (3S,4S,5R)-2-(2-amino-6-methoxypurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol | CAS Registry Number: 121032-29-9
Synonyms: Nelzarabine, Arranon, Nelarabine [USAN], Nelzarabine [USAN], GW 506U78, C11H15N5O5, 506U, 506U78, LS-172477, 9beta-D-Arabinofuranosyl-6-methoxy-9H-purin-2-amine, 9H-Purin-2-amine, 9beta-D-arabinofuranosyl-6-methyl-, 9-beta-D-Arabinofuranosyl-6-methoxy-9H-purin-2-amine, 2-Amino-9-beta-D-arabinofuranosyl-6-methoxy-9H-purine, U78

Molecular Formula: C11H15N5O5Molecular Weight: 297.267300 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 10

InChIKey: IXOXBSCIXZEQEQ-KBNQYOMWSA-N

• Neopterin
IUPAC Name: 2-amino-6-[(1S,2R)-1,2,3-trihydroxypropyl]-1H-pteridin-4-one | CAS Registry Number: 2009-64-5
Synonyms: neopterin, D-Neopterin, D-erythro-Neopterin, D-(+)-Neopterin, D-()-Neopterin, 6-D-erythro-Neopterin, 1,2,3-Proanetriol, N3386_ALDRICH, N3386_SIGMA, CID448839, SMP1_000327, 6-(D-erythro-1,2,3-Trihydroxypropyl)pterin, C05926, 2-Amino-4-hydroxy-6-(1,2,3-trihydroxypropyl)pteridine, 2-Amino-6-((1S,2R)-1,2,3-trihydroxypropyl-4(8H)-pteridone, 4(8H)-pteridinone, 2-amino-6-[(1S,2R)-1,2,3-trihydroxypropyl]-, [S-(R*,S*)]-2-Amino-6-(1,2,3-trihydroxypropyl)-1H-pteridin-4-on, [S-(R*,S*)]-2-amino-6-(1,2,3-trihydroxypropyl)-1H-pteridin-4-one, [S-(R*,S*)]-2-amino-6-(1,2,3-trihydroxypropyl)-1H-pteridine-4-one, NEU

Molecular Formula: C9H11N5O4Molecular Weight: 253.214740 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 8

InChIKey: BMQYVXCPAOLZOK-XINAWCOVSA-N

• Nigericin sodium salt
IUPAC Name: sodium 2-[(3S,6R)-6-[[(5R,7R,9R,10R)-2-[5-[(3S,5R)-5-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-3-methyloxolan-2-yl]-5-methyloxolan-2-yl]-9-methoxy-2,4,10-trimethyl-1,6-dioxaspiro[4.5]decan-7-yl]methyl]-3-methyloxan-2-yl]propanoate | CAS Registry Number: 28643-80-3
Synonyms: nigericin, Nigericin sodium, Sodium nigericin, NIGERICIN, MONOSODIUM SALT, CID34297, NSC 292567

Molecular Formula: C40H67NaO11Molecular Weight: 746.943150 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 11

InChIKey: MOYOTUKECQMGHE-KKCUGXASSA-M

• Nolatrexed dihydrochloride
IUPAC Name: 2-amino-6-methyl-5-pyridin-4-ylsulfanyl-1H-quinazolin-4-one dihydrochloride | CAS Registry Number: 152946-68-4
Synonyms: Thymitaq, Nolatrexed, AG 337, AG-337, LS-186985, 2-Amino-6-methyl-5-(4-pyridinylthio)-4(1H)-quinazolinone dihydrochloride, 4(1H)-Quinazolinone, 2-amino-6-methyl-5-(4-pyridinylthio)-, dihydrochloride, 3,4-Dihydro-2-amino-6-methyl-4-oxo-5-(4-pyridylthio)quinazoline dihydrochloride

Molecular Formula: C14H14Cl2N4OSMolecular Weight: 357.258160 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: PJKVJJYMWOCLIJ-UHFFFAOYSA-N

• Nuciferine
Synonyms: Nuciferin, l-Nuciferine, Sanjoinine E, nuciferine,HCl, (-)-Nucipherine, l-5,6-Dimethoxyaporphine, (R)-1,2-Dimethoxyaporphine, 1,2-Dimethoxy-6abeta-aporphine, CHEBI:562581, AIDS189198, AIDS-189198, CID10146, 6a-beta-APORPHINE, 1,2-DIMETHOXY-, LS-21471, 4H-Dibenzo(de,g)quinoline, 5,6,6a,7-tetrahydro-1,2-dimethoxy-6-methyl-, (R)-, 4H-Dibenzo(de,g)quinoline, 5,6,6a,7-tetrahydro-1,2-dimethoxy-6-methyl-, (R)- (9CI)

Molecular Formula: C19H21NO2Molecular Weight: 295.375540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ORJVQPIHKOARKV-OAHLLOKOSA-N

• OPHIOPOGONIN D
Synonyms: deacetylophiopogonin c pound notojv-v

Molecular Formula: C44H70O16Molecular Weight: 855.028 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 16

InChIKey: FHKHGNFKBPFJCB-BVTJHEIRSA-N

• Ophiopogonin-D
Synonyms: Ophiopogonin D, CID3080802, LS-193522, 11054-29-8, 11088-12-3, beta-D-Galactopyranoside, (1beta,3beta,25R)-3-hydroxyspirost-5-en-1-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-2)-O-(beta-D-xylopyranosyl-(1-3))-6-deoxy-

Molecular Formula: C44H70O16Molecular Weight: 855.017000 [g/mol]
H-Bond Donor: 9H-Bond Acceptor: 16

InChIKey: HCPWJYIKDZWRLK-OFTVQJMASA-N

• Orientin
IUPAC Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one | CAS Registry Number: 28608-75-5
Synonyms: Lutexin, Orientin (Flavone), Luteolin 8-glucoside, Luteolin 8-C-glucoside, 8-beta-D-glucosylluteolin, CHEBI:7781, AIDS026706, AIDS-026706, C21H20O11, CID5281675, LS-39605, C10114, 2-(3,4-Dihydroxyphenyl)-8-beta-D-glucopyranosyl-5,7-dihydroxy-4H-1-benzopyran-4-one, 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-8-beta-D-glucopyranosyl-5,7-dihydroxy-, 8-C-beta-glucopyranosyl-3',4',5,7-tetrahydroxyflav-2-en-3-one, 2-(3,4-dihydroxyphenyl)-8-beta-D-glucopyranosyl-5,7-dihydroxy-4H-chromen-4-one, 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-8-.beta.-D-glucopyranosyl-5,7-dihydroxy-

Molecular Formula: C21H20O11Molecular Weight: 448.376900 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 11

InChIKey: PLAPMLGJVGLZOV-VPRICQMDSA-N

• Oxaliplatin
IUPAC Name: (1R,2R)-cyclohexane-1,2-diamine; oxalate; platinum(2+) | CAS Registry Number: 61825-94-3
Synonyms: oxaliplatin, oxalate, Oxalatoplatin, Oxalatoplatinum, Eloxatin, Eloxatin (TN), platinum(+2) cation, Oxaliplatinum [Latin], Oxaloplatine [French], Oxaliplatino [Spanish], Oxaloplatino [Spanish], Oxaliplatin (JAN/USAN/INN), Oxaliplatin [USAN:INN:BAN], (1R,2R)-cyclohexane-1,2-diamine, DB00526, D01790

Molecular Formula: C8H14N2O4PtMolecular Weight: 397.285760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: ZROHGHOFXNOHSO-BNTLRKBRSA-L

• Paclitaxel
Synonyms: paclitaxel, Yewtaxan, TAXOL, Plaxicel, Paxceed, Taxol A, Abraxane, Ebetaxel, Capxol, Paxene, Onxol, TaxAlbin, LipoPac, Genetaxyl, Nanotaxel, Paclical, Pacligel, Anzatax, Genaxol, Genexol

Molecular Formula: C47H51NO14Molecular Weight: 853.906140 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 14

InChIKey: RCINICONZNJXQF-MZXODVADSA-N

• Palbociclib
IUPAC Name: 6-acetyl-8-cyclopentyl-5-methyl-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrido[2,3-d]pyrimidin-7-one | CAS Registry Number: 571190-30-2
Synonyms: 2euf, CHEBI:419858, CID5330286, PD-0332991, PD-332991, PD0332991, PD 0332991, LQQ, 6-Acetyl-8-cyclopentyl-5-methyl-2-(5-piperazin-1-yl-pyridin-2-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one, 6-Acetyl-8-cyclopentyl-5-methyl-2-(5-piperazin-1-ylpyridin-2-ylamino)-8H-pyrido(2,3-d)pyrimidin-7-one, 6-ACETYL-8-CYCLOPENTYL-5-METHYL-2-[(5-PIPERAZIN-1-YLPYRIDIN-2-YL)AMINO]PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE, Pyrido(2,3-d)pyrimidin-7(8H)-one, 6-acetyl-8-cyclopentyl-5-methyl-2-((5-(1-piperazinyl)-2-pyridinyl)amino)-

Molecular Formula: C24H29N7O2Molecular Weight: 447.532760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: AHJRHEGDXFFMBM-UHFFFAOYSA-N

• Paricalcitol
IUPAC Name: (1R,3R)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-6-hydroxy-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol | CAS Registry Number: 131918-61-1
Synonyms: Zemplar, Paracalcin, Paricalcitol [USAN], Compound 49510, Zemplar (TN), Compound-49510, Paricalcitol (USAN/INN), Abbott brand of paricalcitol, 19-Nor-1alpha,25-dihydroxyvitamin D2, CHEBI:7931, 19-Nor-1,25-(OH)2D2, HSDB 7360, ABT-358, C27H44O3, Ab 122358, DB00910, 19-Nor-1-alpha,25-dihydroxyvitamin D2, LS-172812, C08127, D00930

Molecular Formula: C27H44O3Molecular Weight: 416.636460 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: BPKAHTKRCLCHEA-UBFJEZKGSA-N

• Parthenolide
Synonyms: parthenolide, (-)-Parthenolide, Bio-0620, MEGxp0_000050, ACon1_001961, CHEBI:443035, AIDS007764, AIDS-007764, NSC157035, CID6473881, NSC-157035, (1aR,7aS,10aS,10bS)-1a,5-dimethyl-8-methylidene-2,3,6,7,7a,8,10a,10b-octahydrooxireno[9,10]cyclodeca[1,2-b]furan-9(1aH)-one, (1aR,7aS,10aS,10bS,Z)-1a,5-dimethyl-8-methylene-2,3,6,7,7a,8-hexahydro-11-oxa-bicyclo[8.1.0]undeca-1(10),4-dieno[9,8-b]furan-9(1aH,10aH,10bH)-one, Germacra-1(10),11(13)-dien-12-oic acid, 4,5.alpha.-epoxy-6.beta.-hydroxy-, gamma.-lactone, Oxireno[9,10]cyclodeca[1,2-b]furan-9(1aH)-one, 2,3,6,7,7a,8,10a,10b-octahydro-1a,5-dimethyl-8-methylene-, (1aR,4E,7aS,10aS,10bS)-, PTL

Molecular Formula: C15H20O3Molecular Weight: 248.317500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: KTEXNACQROZXEV-SLXBATTESA-N

• Pazopanib
IUPAC Name: 5-[[4-[(2,3-dimethylindazol-6-yl)-methylamino]pyrimidin-2-yl]amino]-2-methylbenzenesulfonamide | CAS Registry Number: 444731-52-6
Synonyms: GW786034, UNII-7RN5DR86CK, CHEBI:71219, NCGC00188865-01, GW 78603, Pazopanib [INN], DSSTox_CID_28659, DSSTox_RID_82929, DSSTox_GSID_48733, 790713-33-6, Kinome_3790, CHEMBL477772, 5-(4-((2,3-dimethyl-2H-indazol-6-yl)(methyl)amino)pyrimidin-2-ylamino)-2-methylbenzenesulfonamide, 5-[[4-[(2,3-Dimethyl-2H-indazol-6-yl)(methyl)amino]pyrimidin-2-yl]amino]-2-methylbenzenesulfonamide, Benzenesulfonamide, 5-[[4-[(2,3-dimethyl-2H-indazol-6-yl)methylamino]-2-pyrimidinyl]amino]-2-methyl-, CAS-444731-52-6, AKOS005145819, 5-[[4-[(2,3-dimethylindazol-6-yl)-methyl-amino]pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide, ST51053493, pazopanibum

Molecular Formula: C21H23N7O2SMolecular Weight: 437.518020 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: CUIHSIWYWATEQL-UHFFFAOYSA-N

• PD0325901
IUPAC Name: N-[(2R)-2,3-dihydroxypropoxy]-3,4-difluoro-2-(2-fluoro-4-iodoanilino)benzamide | CAS Registry Number: 870474-62-7
Synonyms: 391210-10-9, PD 0325901, PD-0325901, S1036_Selleck, PD325901, PD 325901, PD-325901, CHEMBL507361, ZINC03938683, (R)-N-(2,3-Dihydroxypropoxy)-3,4-difluoro-2-((2-fluoro-4-iodophenyl)amino)benzamide, (R)-N-(2,3-DIHYDROXYPROPOXY)-3,4-DIFLUORO-2-(2-FLUORO-4-IODOPHENYLAMINO)BENZAMIDE, N-{[(2R)-2,3-dihydroxypropyl]oxy}-3,4-difluoro-2-[(2-fluoro-4-iodophenyl)amino]benzamide, DB07101, NCGC00189075-01, S06-0029, N-[((R)-2,3-dihydroxypropyl)oxy]-3,4-difluoro-2-[(2-fluoro-4-iodophenyl)amino]benzamide, 4BM, CID9826528, nchembio.282-comp3, PubChem22394

Molecular Formula: C16H14F3IN2O4Molecular Weight: 482.193040 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: SUDAHWBOROXANE-SECBINFHSA-N

• Pelitinib
IUPAC Name: (E)-N-[4-(3-chloro-4-fluoroanilino)-3-cyano-7-ethoxyquinolin-6-yl]-4-(dimethylamino)but-2-enamide | CAS Registry Number: 257933-82-7
Synonyms: EKB-569, Pelitinib (USAN/INN), WAY-EKB 569, WAY-EKB-569, CHEBI:38927, EKB 569, NSC729742, CID6445562, WAY-172569, D05399, (2E)-N-(4-((3-chloro-4-fluorophenyl)amino)-3-cyano-7-ethoxy-6-quinolinyl)-4-(dimethylamino)-2-butenamide, (2E)-N-{4-[(3-chloro-4-fluorophenyl)amino]-3-cyano-7-ethoxyquinolin-6-yl}-4-(dimethylamino)but-2-enamide, (E)-N-[4-(3-Chloro-4-fluoroanilino)-cyano-7-ethoxyquinolin-6-yl]-4-(dimethlyamino)but-2-enamide,, 2-Butenamide, N-(4-((3-chloro-4-fluorophenyl)amino)-3-cyano-7-ethoxy-6-quinolinyl)-4-(dimethylamino)-, (2E)-, 2-Butenamide, N-[4-(3-chloro-4-fluorophenyl)amino]-3-cyano-7-ethoxy-6-quinolinyl-4-(dimethylamino)-, (E)-,, 4-Dimethylaminobut-2-enoic Acid, [4-(3-Chloro-4-fluoro phenylamino)-3-cyano-7-ethoxyquinoline-6-yl]amide

Molecular Formula: C24H23ClFN5O2Molecular Weight: 467.923123 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: WVUNYSQLFKLYNI-AATRIKPKSA-N

• Pentostatin
IUPAC Name: (8R)-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-8-ol | CAS Registry Number: 53910-25-1
Synonyms: pentostatin, Deoxycoformycin, Nipent, Covidarabine, Oncopent, Vidarbine, Coforin, 2'-Deoxycoformycin, Nipent (TN), Pentostatin (JAN/USAN/INN), 2'-DCF, AIDS072452, AIDS-072452, CI-825, NSC218321, YK-176, NSC-218321, 59979-24-7 (DELETED), PD-81565, CL-67310465

Molecular Formula: C11H16N4O4Molecular Weight: 268.269140 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: FPVKHBSQESCIEP-JQCXWYLXSA-N

• Peramivir
IUPAC Name: (1S,2S,3S,4R)-3-[(1S)-1-acetamido-2-ethylbutyl]-4-(diaminomethylideneamino)-2-hydroxycyclopentane-1-carboxylic acid | CAS Registry Number: 330600-85-6
Synonyms: Rapiacta, BCX-1812, CHEBI:328354, AIDS114230, RWJ-270201, AIDS-114230, CID154234, S-021812, BCZ, 3-(1-ACETYLAMINO-2-ETHYL-BUTYL)-4-GUANIDINO-2-HYDROXY-CYCLOPENTANECARBOXYLIC ACID, 229614-56-6, Cyclopentanecarboxylic acid, 3-((1R)-1-(acetylamino)-2-ethylbutyl)-4-((aminoiminomethyl)amino)-2-hydroxy-, (1R,2R,3S,4S)-rel-, Cyclopentanecarboxylic acid, 3-[(1S)-1-(acetylamino)-2-ethylbutyl]-4-[(aminoiminomethyl)amino]-2-hydroxy-, (1S,2S,3R,4R)-

Molecular Formula: C15H28N4O4Molecular Weight: 328.407220 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 7

InChIKey: XRQDFNLINLXZLB-CKIKVBCHSA-N

• Peramivir Trihydrate
IUPAC Name: (1S,2S,3S,4R)-3-[(1S)-1-acetamido-2-ethylbutyl]-4-(diaminomethylideneamino)-2-hydroxycyclopentane-1-carboxylic acid;trihydrate | CAS Registry Number: 1041434-82-5
Synonyms: Peramivir trihydrate, Peramivir, UNII-QW7Y7ZR15U, Rapiacta trihydrate, BCX 1812 trihydrate, QW7Y7ZR15U, CS-0732, HY-17015, AB2000705, Y0248, Peramivir trihydrate|1041434-82-5|Rapiacta trihydrate|BCX 1812 trihydrate, (1S,2S,3R,4R)-4-carbamimidamido-3-[(1S)-1-acetamido-2-ethylbutyl]-2-hydroxycyclopentane-1-carboxylic acid trihydrate

Molecular Formula: C15H34N4O7Molecular Weight: 382.453060 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 8

InChIKey: RFUCJKFZFXNIGB-ZBBHRWOZSA-N

• Phenol, 3-[2-[2-cyclopentyl-6-[[4-(dimethylphosphinyl)phenyl]amino]-9H-purin-9-yl]ethyl]-
IUPAC Name: 3-[2-[2-cyclopentyl-6-(4-dimethoxyphosphorylanilino)purin-9-yl]ethyl]phenol | CAS Registry Number: 845895-51-4
Synonyms: BCP9000306

Molecular Formula: C26H30N5O4PMolecular Weight: 507.521262 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: PADCFSVZOYFPCZ-UHFFFAOYSA-N

• Pheophorbide A
Synonyms: Pheophorbide a, Phaeophorbid a, Phaeophorbid-a, 13-epi-Phaeophorbide-a, CCRIS 8091, CHEBI:38257, EINECS 239-738-5, NSC75783, CID5323510, NCI60_041663, LS-186776, LS-187452, (3S-(3alpha,4beta,21beta))-14-Ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinylphorbine-3-propionic acid, 3-Phorbinepropanoic acid, 9-ethenyl-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-, (3S,4S,21R)-, (2(2)R,17S,18S)-7-ethyl-2(1),2(2),17,18-tetrahydro-2(2)-(methoxycarbonyl)-3,8,13,17-tetramethyl-2(1)-oxo-12-ethenylcyclopenta[at]porphyrin-18-propanoic acid, (3S,4S,21R)-9-ethenyl-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoic acid, 28979-78-4, 29702-69-0, 3-[(3S,4S,21R)-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinylphorbin-3-yl]propanoic acid, 3-phorbinepropanoic acid, 9-ethenyl-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-, (3S,4S)-

Molecular Formula: C35H36N4O5Molecular Weight: 592.684140 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: OINDWIFDMFYGDX-LDCXZXNSSA-N

• Picoplatin
IUPAC Name: azane; 2-methylpyridine; platinum(2+); dichloride | CAS Registry Number: 181630-15-9
Synonyms: Picoplatin [INN:BAN], AMD 473, AMD-473, JM-473, ZD0473, ZD 0473, CID177358, Amminedichloro(2-methylpyridine)platinum(ii), LS-184068, (SP-4-3)-Amminedichloro(2-methylpyridine)platinium, Platinum, amminedichloro(2-methylpyridine)-, (SP-4-3)-

Molecular Formula: C6H10Cl2N2PtMolecular Weight: 376.141000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: IIMIOEBMYPRQGU-UHFFFAOYSA-L

• Pictilisib
IUPAC Name: 4-[2-(1H-indazol-4-yl)-6-[(4-methylsulfonylpiperazin-1-yl)methyl]thieno[3,2-d]pyrimidin-4-yl]morpholine | CAS Registry Number: 957054-30-7
Synonyms: GDC-0941, GDC0941, GDC 0941, Pictrelisib, S1065_Selleck, Kinome_3719, CHEMBL521851, 4-(2-(1H-Indazol-4-yl)-6-((4-(methylsulfonyl)piperazin-1-yl)methyl)thieno[3,2-d]pyrimidin-4-yl)morpholine, CHEBI:65326, GDC-0941, GDC0941, 2-(1H-Indazol-4-yl)-6-(4-methanesulfonylpiperazin-1-ylmethyl)-4-morpholin-4-yl-thieno[3,2-d]pyrimidine, 4-[2-(1H-indazol-4-yl)-6-[(4-methylsulfonylpiperazin-1-yl)methyl]thieno[3,2-d]pyrimidin-4-yl]morpholine, GD9, 2-(1h-Indazol-4-Yl)-6-{[4-(Methylsulfonyl)piperazin-1-Yl]methyl}-4-Morpholin-4-Yl-Thieno[3,2-D]pyrimidine, 4-(2-(1H-indazol-4-yl)-6-((4-(methylsulfonyl)piperazin-1-yl)methyl)thieno(3,2-d)pyrimidin-4-yl)morpholine, Pictrelisib [INN], Pictilisib (USAN), PICTILISIB, PubChem16427, nchembio.293-comp12

Molecular Formula: C23H27N7O3S2Molecular Weight: 513.635580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 10

InChIKey: LHNIIDJUOCFXAP-UHFFFAOYSA-N

• Pilaralisib analogue
IUPAC Name: N-[3-(2,1,3-benzothiadiazol-5-ylamino)quinoxalin-2-yl]-4-methylbenzenesulfonamide | CAS Registry Number: 956958-53-5
Synonyms: XL147, XL 147, SAR245408, XL-147, N-[3-(2,1,3-Benzothiadiazol-5-ylamino)-2-quinoxalinyl]-4-methylbenzenesulfonamide, SAR 245408, N-[3-(2,1,3-benzothiadiazol-5-ylamino)quinoxalin-2-yl]-4-methylbenzenesulfonamide, XL 147, XL-147, 956958-53-5, N-(3-(benzo[c][1,2,5]thiadiazol-5-ylamino)quinoxalin-2-yl)-4-methylbenzenesulfonamide, PubChem22457, cc-43, SureCN1792641, CHEBI:71957, MolPort-016-633-179, ABP000084, STL325024, XL147-Supplied by Selleck Chemicals, AKOS015842552, CS-0088, MCULE-9777093020

Molecular Formula: C21H16N6O2S2Molecular Weight: 448.520740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 9

InChIKey: MQMKRQLTIWPEDM-UHFFFAOYSA-N

• Pinostilbene
IUPAC Name: 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol | CAS Registry Number: 42438-89-1
Synonyms: CHEBI:63672, 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol, 3-methoxyresveratrol, NSC723532, AC1NV8IH, SureCN562335, CHEMBL498917, ZINC06483567, AKOS015915100, AC-7026, NSC-723532, 3,4'-Dihydroxy-5-methoxy-trans-stilbene, AK-48859, FT-0659983, P1927, ST51054408, C20154, I14-6898

Molecular Formula: C15H14O3Molecular Weight: 242.269860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: KUWZXOMQXYWKBS-NSCUHMNNSA-N

• Piperazine, 2,5-dimethyl-1-(phenylmethyl)-, (2R,5R)-
IUPAC Name: (2R,5R)-1-benzyl-2,5-dimethylpiperazine;dihydrochloride | CAS Registry Number: 324750-43-8
Synonyms: (2R,5R)-1-benzyl-2,5-dimethylpiperazine dihydrochloride, AG-F-08564, CTK4G8761, AKOS015845632, AK133421, A821290, I13-0203, (2R,5R)-2,5-dimethyl-1-(phenylmethyl)piperazine dihydrochloride

Molecular Formula: C13H22Cl2N2Molecular Weight: 277.233180 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: NNOPREOUOQQPDC-MBORUXJMSA-N

• Piperazine-2-Carboxylic Acid Dihydrochloride
IUPAC Name: (2S)-piperazine-1,4-diium-2-carboxylate | CAS Registry Number: 3022-15-9
Synonyms: ZINC03860731

Molecular Formula: C5H11N2O2+Molecular Weight: 131.153040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: JSSXHAMIXJGYCS-BYPYZUCNSA-O

• Piperazine-2-carboxylic acid methyl ester dihydrochloride
IUPAC Name: methyl piperazine-2-carboxylate;dihydrochloride | CAS Registry Number: 122323-88-0
Synonyms: Methyl Piperazine-2-carboxylate Dihydrochloride, Piperazine-2-carboxylicacidmethylesterdihydrochloride, PIPERAZINE-2-CARBOXYLIC ACID METHYL ESTER-2HCl, 3-aminopiperidine-3-carboxylic acid dihydrochloride, PubChem24366, AC1MC2NE, SureCN1512332, KSC791E8T, CTK6J1289, MolPort-000-158-316, ANW-48742, AKOS015845300, AG-B-43496, AK-44504, BR-44504, KB-80032, FT-0083936, FT-0659371, X9518, A12937

Molecular Formula: C6H14Cl2N2O2Molecular Weight: 217.093560 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: ZBYFDUSYNDLSND-UHFFFAOYSA-N

• Platycodin D
IUPAC Name: [(2S,3R,4S,5S)-3-[(2S,3R,4S,5R,6S)-5-[(2S,3R,4S,5R)-4-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-3,5-dihydroxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10R,11S,12aR,14bS)-5,11-dihydroxy-9,9-bis(hydroxymethyl)-2,2,6a,6b,12a-pentamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | CAS Registry Number: 58479-68-8
Synonyms: CID162859, LS-193714, Olean-12-en-28-oic acid, 3-(beta-D-glucopyranosyloxy)-2,16,23,24-tetrahydroxy-, O-D-apio-beta-D-furanosyl-(1-3)-O-beta-D-xylopyranosyl-(1-4)-O-6-deoxy-alpha-L-mannopyranosyl-(1-2)-L-arabinopyranosyl ester, (2beta,3beta,16alpha)-

Molecular Formula: C57H92O28Molecular Weight: 1225.323580 [g/mol]
H-Bond Donor: 17H-Bond Acceptor: 28

InChIKey: CYBWUNOAQPMRBA-NDTOZIJESA-N

• Plerixafor
IUPAC Name: 1-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]-1,4,8,11-tetrazacyclotetradecane | CAS Registry Number: 110078-46-1
Synonyms: Mozobil, AMD3100, Amd 3100, bicyclam JM-2987, JM 3100, AMD-3100, UNII-S915P5499N, JM3100, JM-3100, Mozobil (TN), SID791, 155148-31-5, 1,4-Bis((1,4,8,11-tetraazacyclotetradecan-1-yl)methyl)benzene, 1,1'-[1,4-Phenylenebis(methylene)]bis-1,4,8,11-tetraazacyclotetradecane, AC1L22ET, 1-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]-1,4,8,11-tetrazacyclotetradecane, CHEMBL18442, SDZ SID 791, GNA & AMD-3100, HHA & AMD-3100

Molecular Formula: C28H54N8Molecular Weight: 502.781960 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 8

InChIKey: YIQPUIGJQJDJOS-UHFFFAOYSA-N

• Plerixafor octahydrochloride
IUPAC Name: 1-[[4-(1,5,8,12-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]-1,5,8,12-tetrazacyclotetradecane | CAS Registry Number: 155148-31-5
Synonyms: Plerixafor, Mozobil, bicyclam JM-2987, AMD3100, Amd 3100, SDZ SID 791, SID791, UNII-S915P5499N, GNA & AMD-3100, HHA & AMD-3100, CHEBI:120346, AIDS025303, AIDS224013, AIDS224020, AIDS-025303, AIDS-224013, AIDS-224020, AMD-3100, CID65015, JM 3100

Molecular Formula: C28H54N8Molecular Weight: 502.781960 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 8

InChIKey: YIQPUIGJQJDJOS-UHFFFAOYSA-N

• Plx-4032
IUPAC Name: N-[3-[5-(4-chlorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonyl]-2,4-difluorophenyl]propane-1-sulfonamide | CAS Registry Number: 1029872-54-5
Synonyms: Vemurafenib, Zelboraf, PLX-4032, RG7204, 918504-65-1, PLX4032, PLX 4032, UNII-207SMY3FQT, RO5185426, CHEBI:63637, RG-7204, RO-5185426, N-(3-(5-(4-Chlorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonyl)-2,4-difluorophenyl)propane-1-sulfonamide, N-[3-[[5-(4-Chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]-2,4-difluorophenyl]-1-PropanesulfonaMide, PLX4032, RG7204, RO5185426, 1029872-54-5, 1-PROPANESULFONAMIDE, N-[3-[[5-(4-CHLOROPHENYL)-1H-PYRROLO[2,3-B]PYRIDIN-3-YL]CARBONYL]-2,4-DIFLUOROPHENYL]-, N-(3-{[5-(4-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl}-2,4-difluorophenyl)propane-1-sulfonamide, RG7204, R7204, RO5185426, PLX4032, PLX-4032, Zelboraf (TN), N-(3-((5-(4-Chlorophenyl)-1H-pyrrolo(2,3-b)pyridin-3-yl)carbonyl)-2,4- difluorophenyl)propane-1-sulfonamide

Molecular Formula: C23H18ClF2N3O3SMolecular Weight: 489.922126 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: GPXBXXGIAQBQNI-UHFFFAOYSA-N

• Pneumocandin B0
Synonyms: Pneumocandin Bo, Hydroxy Echinocandin, AIDS008540, AIDS-008540, CID5742645, L-688,786, (2R,6S,9S,11R,12R,14aS,15S,20S,23S,25aS)-20-[2-Carbamoyl-1(R)-hydroxyethyl]-23-[1(S),2(S)-dihydroxy-2-(4-hydroxyphenyl)ethyl]-9-(10,12-dimethyltetradecanamido)-2,11,12,15-tetrahydroxy-6-[1(R)-hydroxyethyl]perhydrodipyrrolo[2,1-c:2',1'-l][1,4,7,10,13,16]hexaazacycloheneicosine-5,8,14,19,22,25-hexaone

Molecular Formula: C50H80N8O17Molecular Weight: 1065.213600 [g/mol]
H-Bond Donor: 15H-Bond Acceptor: 17

InChIKey: DQXPFAADCTZLNL-ZESADUFFSA-N

• Pomalidomide
IUPAC Name: 4-amino-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione | CAS Registry Number: 19171-19-8
Synonyms: Actimid, 4-Aminothalidomide, IMiD1, IMiD 3, UNII-D2UX06XLB5, IMID-4047, CDC-394, CHEBI:163100, CC-4047, CID134780, CC 4047, 3-Amino-N-(2,6-dioxo-3-piperidyl)phthalimide, Phthalimide, 3-amino-N-(2,6-dioxo-3-piperidyl)-, 4-Amino-2-(2,6-dioxo-3-piperidyl)isoindoline-1,3-dione, 4-amino-2-(2,6-dioxopiperidin-3-yl)isoindoline-1,3-dione, 4-Amino-2-(2,6-dioxo-piperidin-3-yl)-isoindole-1,3-dione, 1H-Isoindole-1,3(2H)-dione, 4-amino-2-(2,6-dioxo-3-piperidinyl)-, 443912-23-0, 443919-33-3

Molecular Formula: C13H11N3O4Molecular Weight: 273.244140 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: UVSMNLNDYGZFPF-UHFFFAOYSA-N

• Ponatinib
IUPAC Name: 3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide | CAS Registry Number: 943319-70-8
Synonyms: PONATINIB, Iclusig, AP-24534, AP24534, AP-24534, Ponatinib, AP24534, AP 24534, UNII-4340891KFS, 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)benzamide, 3-(2-(Imidazo[1,2-b]pyridazin-3-yl)ethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)benzamide, BENZAMIDE, 3-(2-IMIDAZO[1,2-B]PYRIDAZIN-3-YLETHYNYL)-4-METHYL-N-[4-[(4-METHYL-1-PIPERAZINYL)METHYL]-3-(TRIFLUOROMETHYL)PHENYL]-, 0LI, 3-(Imidazo[1,2-B]pyridazin-3-Ylethynyl)-4-Methyl-N-{4-[(4-Methylpiperazin-1-Yl)methyl]-3-(Trifluoromethyl)phenyl}benzamide, S1490_Selleck, AP24534,Ponatinib, Ponatinib (USAN/INN), Ponatinib [USAN:INN], AP24534 - Ponatinib, Ponatinib (AP24534), SureCN589260, QCR-6

Molecular Formula: C29H27F3N6OMolecular Weight: 532.559490 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: PHXJVRSECIGDHY-UHFFFAOYSA-N

• Posaconazole
IUPAC Name: 4-[4-[4-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-[(2S,3S)-2-hydroxypentan-3-yl]-1,2,4-triazol-3-one | CAS Registry Number: 171228-49-2
Synonyms: Spriafil, Noxafil, Posaconazole SP, Sch 56592, SCH-56592, AIDS058495, AIDS-058495, SCH56592, 1-((1S,2S)-1-Ethyl-2-hydroxypropyl)-4-{4-[4-(4-{[(5S,3R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazolylmethyl)oxolan-3-yl]methoxy}phenyl)piperazinyl]phenyl}-1,2,4-triazolin-5-one, PCZ, POS

Molecular Formula: C37H42F2N8O4Molecular Weight: 700.777386 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 12

InChIKey: RAGOYPUPXAKGKH-XAKZXMRKSA-N

• PP121
IUPAC Name: 1-cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrazolo[3,4-d]pyrimidin-4-amine | CAS Registry Number: 1092788-83-4
Synonyms: 1-cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, CHEBI:50915, PP 121, PP-121, PP-121, PP 121, 1092788-83-4, PP121, PP-121, KS1, S2622_Selleck, Kinome_2001, SureCN12265009, cc-496, CHEMBL1081312, CTK8E9536, CHEBI:716450, ABP000938, CS-0087, DB08052, RL00398, NCGC00346619-01, EN002865

Molecular Formula: C17H17N7Molecular Weight: 319.363780 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: NVRXTLZYXZNATH-UHFFFAOYSA-N

• Pristimerin
IUPAC Name: methyl (2R,4aS,6aS,6aR,14aS,14bR)-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylate | CAS Registry Number: 1258-84-0
Synonyms: Celastrol-methylether, Spectrum_001558, SpecPlus_000649, Spectrum2_000546, Spectrum3_001651, Spectrum4_001681, Spectrum5_000322, BSPBio_003401, KBioGR_001942, KBioSS_002038, DivK1c_006745, SPECTRUM1504181, SPBio_000591, MEGxp0_000269, ACon0_000836, KBio1_001689, KBio2_002038, KBio2_004606, KBio2_007174, KBio3_002621

Molecular Formula: C30H40O4Molecular Weight: 464.636200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JFACETXYABVHFD-WXPPGMDDSA-N

• Prostaglandin E1
IUPAC Name: 7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoic acid | CAS Registry Number: 745-65-3
Synonyms: alprostadil, Befar, Prostandin, Prostavasin, Caverject, Topiglan, Femprox, Sugiran, Viridal, Alista, Prink, Edex, Muse, FemLife, Prostin VR, Alprox-TD, PGE1, PGE1 Oligomer, Befar (TN), Prink (TN)

Molecular Formula: C20H34O5Molecular Weight: 354.480960 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: GMVPRGQOIOIIMI-DWKJAMRDSA-N

• Prostaglandin E2
IUPAC Name: (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid | CAS Registry Number: 363-24-6
Synonyms: Dinoprostone, Dinoproston, Prepidil, Prostin, PGE2, Prostin E2, Cervidil, Glandin, l-Prostaglandin E2, Prepidil Gel, Minprositin E2, Minprostin E2, PGE2alpha, Cervidil (TN), PGE2 alpha, Prepidil (TN), l-PGE2, Prestwick_793, (15S)-Prostaglandin E2, Prostaglandin E2alpha

Molecular Formula: C20H32O5Molecular Weight: 352.465080 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: XEYBRNLFEZDVAW-ARSRFYASSA-N

• Prucalopride
IUPAC Name: 4-amino-5-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide | CAS Registry Number: 179474-81-8
Synonyms: Resolor, UNII-0A09IUW5TP, CHEBI:291172, CID3052762, L000891, R093877, R 093877, 4-Amino-5-chloro-2,3-dihydro-N-(1-(3-methoxypropyl)-4-piperidyl)-7-benzofurancarboxamide, 4-Amino-5-chloro-2,3-dihydro-benzofuran-7-carboxylic acid [1-(3-methoxy-propyl)-piperidin-4-yl]-amide

Molecular Formula: C18H26ClN3O3Molecular Weight: 367.870340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: ZPMNHBXQOOVQJL-UHFFFAOYSA-N

• Prucalopride Succinate
IUPAC Name: 4-amino-5-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;butanedioic acid | CAS Registry Number: 179474-85-2
Synonyms: Prucalopride succinate, Resolor, R-108512, BUTANEDIOIC ACID 4-AMINO-5-CHLORO-2,3-DIHYDRO-N-[1-(3-METHOXYPROPYL)-4-PIPERIDINYL]-7-BENZOFURANCARBOXAMIDE, Prucalopride succinate (USAN), Prucalopride succinate [USAN], R-093877, Resolor (TN), Prucalopride Succinat, SureCN1230437, UNII-4V2G75E1CK, CHEMBL2105748, MolPort-020-313-414, DCL000854, AKOS015994741, KB-6806, RL02294, KB-48488, Y0234, D10152

Molecular Formula: C22H32ClN3O7Molecular Weight: 485.958380 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 9

InChIKey: QZRSNVSQLGRAID-UHFFFAOYSA-N

• PSI
IUPAC Name: tert-butyl (4S)-5-[[(2S)-1-[[(2S)-4-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-[[(2S,3R)-3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-5-oxopentanoate | CAS Registry Number: 158442-41-2

Molecular Formula: C32H50N4O8Molecular Weight: 618.761400 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: TYFTWYMXUWCOOB-XYXXBXNNSA-N

• Psoralen
IUPAC Name: furo[3,2-g]chromen-7-one | CAS Registry Number: 66-97-7
Synonyms: Ficusin, Furocoumarin, Psoralene, Psorline-P, Phytoalexin, Psolaren, 6,7-Furanocoumarin, Furo(3,2-g)-coumarin, PHYTOALEXIN-CMPD, Furo[3,2-g]coumarin, 7H-Furo[3,2-g][1]benzopyran-7-one, CCRIS 4343, Furo(2',3',7,6)coumarin, Furo(4',5',6,7)coumarin, Furo[4',5':6,7]coumarin, Oprea1_841692, HSDB 3528, MLS001304059, P8399_SIGMA, 7H-Furo[3,2-g]chromen-7-one

Molecular Formula: C11H6O3Molecular Weight: 186.163540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ZCCUUQDIBDJBTK-UHFFFAOYSA-N

• PU-H71
IUPAC Name: 8-[(6-iodo-1,3-benzodioxol-5-yl)sulfanyl]-9-[3-(propan-2-ylamino)propyl]purin-6-amine | CAS Registry Number: 873436-91-0
Synonyms: PU H71, 2fwz, SureCN1857579, cc-124, UNII-06IVK87M04, CHEMBL200102, PUH-71, PU-H71, d6, PU-H 71, PU-H-71, CHEBI:435628, NSC 750424-d6, NSC752199, CS-0546, NSC-752199, RL05427, H71, HY-11038, BCP0726000178, KB-145999

Molecular Formula: C18H21IN6O2SMolecular Weight: 512.367810 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: SUPVGFZUWFMATN-UHFFFAOYSA-N

• Pyrocatechol monoglucoside
IUPAC Name: (2R,3S,4S,5R)-2-(hydroxymethyl)-6-(2-hydroxyphenoxy)oxane-3,4,5-triol | CAS Registry Number: 2400-71-7
Synonyms: (2R,3S,4S,5R)-2-(Hydroxymethyl)-6-(2-hydroxyphenoxy)tetrahydro-2H-pyran-3,4,5-triol, SCHEMBL1706261, AKOS022184860, AK104286, ST24034028, W2831

Molecular Formula: C12H16O7Molecular Weight: 272.251240 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 7

InChIKey: NMZWIAATAZXMRV-OZRWLHRGSA-N

• Quizartinib
IUPAC Name: 1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[4-[6-(2-morpholin-4-ylethoxy)imidazo[2,1-b][1,3]benzothiazol-2-yl]phenyl]urea | CAS Registry Number: 950769-58-1
Synonyms: AC-220, AC220, AC 220, AC010220, AC-220, AC220, AC220,Quizartinib, S1526_Selleck, AC220 - Quizartinib, SureCN72923, Quizartinib (USAN/INN), Quizartinib [USAN:INN], cc-62, UNII-7LA4O6Q0D3, CHEMBL576982, CHEBI:673133, BCPP000443, HMS3244K09, HMS3244K10, HMS3244L09, HMS3265G09

Molecular Formula: C29H32N6O4SMolecular Weight: 560.667180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: CVWXJKQAOSCOAB-UHFFFAOYSA-N

• R)-(+)-Piperazine-2-carboxylic acid methyl ester dihydrochloride
IUPAC Name: methyl (2R)-piperazine-2-carboxylate;dihydrochloride | CAS Registry Number: 637027-25-9
Synonyms: (R)-Methyl piperazine-2-carboxylate dihydrochloride, (R)-PIPERAZINE-2-CARBOXYLIC ACID METHYL ESTER-2HCl, (R)-PIPERAZINE-2-CARBOXYLIC ACID METHYL ESTER DIHYDROCHLORIDE, (r)-piperazine-2-carboxylic acid methyl ester 2hcl, SureCN282695, CTK6I6370, MolPort-020-014-033, ACT09970, ANW-61384, AKOS015845243, AKOS015897893, AG-A-07684, PB16053, AK-45080, KB-144748, ST51051444, W7554, A-1717, I13-0254, METHYL (2R)-PIPERAZINE-2-CARBOXYLATE DIHYDROCHLORIDE

Molecular Formula: C6H14Cl2N2O2Molecular Weight: 217.093560 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: ZBYFDUSYNDLSND-ZJIMSODOSA-N

• R-2-ISOBUTYL-PIPERAZINE
IUPAC Name: (2R)-2-(2-methylpropyl)piperazine;dihydrochloride | CAS Registry Number: 853730-57-1
Synonyms: (R)-2-Isobutylpiperazine dihydrochloride, MolPort-021-784-370, AKOS015924315, r-2-isobutyl-piperazine dihydrochloride, AK-42241, KB-144422, W8809

Molecular Formula: C8H20Cl2N2Molecular Weight: 215.163800 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 2

InChIKey: QYTGHACPXVRWBK-YCBDHFTFSA-N


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