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All Chemistry Inc.

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Profile: ALL Chemistry Inc. is your reliable partner for contract research and advanced synthesis and analysis. We specialize in providing professional chemical products and custom solutions for pharmaceutical and biotechnological industries and research institutions on a global scale. Our extensive catalog of research chemicals covers chiral compounds, natural compounds, labeled products, small molecule inhibitors, flavor and fragrance products, and we offer custom synthesis, custom compound screening and library services upon customer requirements.

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• Carbetapentane citrate
IUPAC Name: 2-(2-diethylaminoethyloxy)ethyl 1-phenylcyclopentane-1-carboxylate; 2-hydroxypropane-1,2,3-tricarboxylic acid | CAS Registry Number: 23142-01-0
Synonyms: Loucarbate, Toclase, Toclase citrate, Astomatop, Pentoxyverine citrate, Pentoxiverine citrate, Astomatop (TN), Carbetapentone citrate, Prestwick_748, Ambap5010, Carbetapentane citrate salt, Lopac-C-4662, MLS000859895, C4662_SIGMA, SPECTRUM1501129, Pentoxyverine citrate (JP15), EINECS 245-449-5, NCGC00016128-01, NCGC00017090-01, NCGC00093760-01

Molecular Formula: C26H39NO10Molecular Weight: 525.588560 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 11

InChIKey: AKJDEXBCRLOVTH-UHFFFAOYSA-N

• Carboxyamidotriazole Orotate
IUPAC Name: 5-amino-1-[[3,5-dichloro-4-(4-chlorobenzoyl)phenyl]methyl]triazole-4-carboxamide;2,4-dioxo-1H-pyrimidine-5-carboxylic acid | CAS Registry Number: 187739-60-2
Synonyms: Carboxiamidotriazol orotate, SB17292

Molecular Formula: C22H16Cl3N7O6Molecular Weight: 580.763 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 9

InChIKey: USNBVLGWGCHQNR-UHFFFAOYSA-N

• Carfilzomib
IUPAC Name: (2S)-4-methyl-N-[(2S)-1-[[(2S)-4-methyl-1-[(2R)-2-methyloxiran-2-yl]-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-2-[[(2S)-2-[(2-morpholin-4-ylacetyl)amino]-4-phenylbutanoyl]amino]pentanamide | CAS Registry Number: 868540-17-4
Synonyms: Carfilzomib (INN/USAN), CHEBI:620664, PR-171, CID11556711, CID 11556711, D08880

Molecular Formula: C40H57N5O7Molecular Weight: 719.909880 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: BLMPQMFVWMYDKT-NZTKNTHTSA-N

• Carvacrol
IUPAC Name: 2-methyl-5-propan-2-ylphenol | CAS Registry Number: 499-75-2
Synonyms: CARVACROL, Antioxine, Karvakrol, o-Thymol, Isothymol, Isopropyl-o-cresol, 2-p-Cymenol, p-Cymen-2-ol, 5-Isopropyl-2-methylphenol, 2-Hydroxy-p-cymene, 5-Isopropyl-o-cresol, Cymene-2-ol, p-, p-Cymene, 2-hydroxy-, Caswell No. 511, o-Cresol, 5-isopropyl-, 2-Methyl-5-isopropylphenol, Ambap1479, 3-Isopropyl-6-methylphenol, 6-Methyl-3-isopropylphenol, Phenol, 2-methyl-5-(1-methylethyl)-

Molecular Formula: C10H14OMolecular Weight: 150.217560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: RECUKUPTGUEGMW-UHFFFAOYSA-N

• Cephaeline dihydrochloride
IUPAC Name: (1R)-1-[[(3R)-3-ethyl-9,10-dimethoxy-1,2,3,4,5,6,7,11b-octahydrobenzo[a]quinolizin-5-ium-2-yl]methyl]-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-6-ol dichloride | CAS Registry Number: 5853-29-2
Synonyms: CEPHAELINE HCL, Cephaleine hydrochloride, Cephaeline, dihydrochloride, CEPHAELINE HYDROCHLORIDE, (-)-Cephaeline dihydrochloride, CEPHAELINE DIHYDROCHLORIDE, EINECS 227-463-3, NSC 32944, Cephaeline, dihydrochloride (8CI), CID22126, LS-52739, 7',10,11-Trimethoxyemetan-6'-ol dihydrochloride, Emetan-6'-ol, 7',10,11-trimethoxy-, dihydrochloride, Emetan-6'-ol, 7',10,11-trimethoxy-, dihydrochloride (9CI)

Molecular Formula: C28H40Cl2N2O4Molecular Weight: 539.534200 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: YAOHSWWVTZSRQM-ILYWHXRNSA-N

• Cephalotaxine
Synonyms: Alkaloid A from Cephalotaxus, Cephalotaxine (8CI)(9CI), CHEBI:3540, CID65305, NSC245454, NSC 128487, NSC 245454, NSC 245455, SMP1_000194, NCGC00160146-01, C10580

Molecular Formula: C18H21NO4Molecular Weight: 315.363640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: YMNCVRSYJBNGLD-KURKYZTESA-N

• Ceramides Mixture
IUPAC Name: (Z)-N-[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]octadec-9-enamide | CAS Registry Number: 100403-19-8
Synonyms: N-oleoyl-phytosphingosine, N-oloeoyl-4-hydroxysphinganine, PHCer C18:1(n-9), UNII-4370DF050B, CHEBI:85204, ATGQXSBKTQANOH-UWVGARPKSA-N, N-(9Z-octadecenoyl)phytosphingosine, Cer(t18:0/18:1n-9), EINECS 309-560-3, N-(9Z-octadecenoyl)-4-hydroxysphinganine, (9Z)-N-[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]octadec-9-enamide

Molecular Formula: C36H71NO4Molecular Weight: 581.953240 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: ATGQXSBKTQANOH-UWVGARPKSA-N

• Cerdulatinib
IUPAC Name: 4-(cyclopropylamino)-2-[4-(4-ethylsulfonylpiperazin-1-yl)anilino]pyrimidine-5-carboxamide | CAS Registry Number: 1198300-79-6
Synonyms: UNII-D1LXQ45S1O, PRT2070, PRT 2070, PRT-2070, PRT 062070, PRT-062070, Cerdulatinib [INN], SureCN736734, AGN-PC-077VAF, D1LXQ45S1O, CS-3329, HY-15999, 4-(cyclopropylamino)-2-[4-(4-ethylsulfonylpiperazin-1-yl)anilino]pyrimidine-5-carboxamide, 4-(Cyclopropylamino)-2-((4-(4-(ethanesulfonyl)piperazin-1-yl)phenyl)amino)pyrimidine-5-carboxamide, 5-Pyrimidinecarboxamide, 4-(cyclopropylamino)-2-((4-(4-(ethylsulfonyl)-1-piperazinyl)phenyl)amino)-

Molecular Formula: C20H27N7O3SMolecular Weight: 445.538480 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 9

InChIKey: BGLPECHZZQDNCD-UHFFFAOYSA-N

• Cerebroside B
IUPAC Name: 2-hydroxy-N-[3-hydroxy-9-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadeca-4,8-dien-2-yl]hexadecanamide | CAS Registry Number: 88642-46-0

Molecular Formula: C41H77NO9Molecular Weight: 728.065 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 9

InChIKey: YBSQGNFRWZKFMJ-UHFFFAOYSA-N

• CGP60474
IUPAC Name: 3-[[4-[2-(3-chloroanilino)pyrimidin-4-yl]pyridin-2-yl]amino]propan-1-ol | CAS Registry Number: 164658-13-3
Synonyms: MLS000911536, CGP 60474, CHEBI:178520, CGP-60474, CID644215, SMR000463552, 1-propanol, 3-[[4-[2-[(3-chlorophenyl)amino]-4-pyrimidinyl]-2-pyridinyl]amino]-, 1-Propanol, 3-[[4-[2-[(3-chlorophenyl)amino]-4-pyrimidinyl]-2-pyridinyl]amino]- (9CI), 3-{4-[2-(3-Chloro-phenylamino)-pyrimidin-4-yl]-pyridin-2-ylamino}-propan-1-ol

Molecular Formula: C18H18ClN5OMolecular Weight: 355.821420 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: IYNDTACKOAXKBJ-UHFFFAOYSA-N

• Chelerythrine
IUPAC Name: 1,2-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium | CAS Registry Number: 34316-15-9
Synonyms: chelerythrine, Toddalin, Toddaline, Chelerythrine chloride, Helleritrine hydroxide, Chelerythrine hydroxide, nchembio873-comp36, Chelerythrinium hydroxide, Chelerythrine aurichloride, Lopac-C-2932, Benzophenanthridine alkaloid, Lopac0_000241, BSPBio_001558, 478-03-5 (hydroxide), MEGxp0_001953, 3895-92-9 (chloride), C21H18NO4, EINECS 251-930-0, CID2703, CHEBI:111199

Molecular Formula: C21H18NO4+Molecular Weight: 348.371920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: LLEJIEBFSOEYIV-UHFFFAOYSA-N

• Chitosan oligosaccharide
IUPAC Name: (2R,3S,4R,5R,6S)-5-amino-6-[(2R,3S,4R,5R,6R)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-2-(hydroxymethyl)oxane-3,4-diol | CAS Registry Number: 148411-57-8
Synonyms: Chitosan oligosaccharide lactate, SureCN186177, 523682_ALDRICH, CHEBI:50677, 2-amino-4-O-(2-amino-2-deoxy-beta-D-glucopyranosyl)-2-deoxy-beta-D-glucopyranose

Molecular Formula: C12H24N2O9Molecular Weight: 340.326960 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 11

InChIKey: QLTSDROPCWIKKY-PMCTYKHCSA-N

• Chloramphenicol
IUPAC Name: 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide | CAS Registry Number: 56-75-7
Synonyms: chloramphenicol, Chloromycetin, Levomicetina, Levomycetin, Chlornitromycin, Chloramficin, Chloramfilin, Chloronitrin, Ciplamycetin, Detreomycine, Dextromycetin, Enteromycetin, Intramycetin, Levomitsetin, Mediamycetine, Micochlorine, Amphenicol, Aquamycetin, Biophenicol, Chemicetin

Molecular Formula: C11H12Cl2N2O5Molecular Weight: 323.129380 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: WIIZWVCIJKGZOK-RKDXNWHRSA-N

• CHLORO CYCLIZINE HYDROCHLORIDE
IUPAC Name: 1-[(4-chlorophenyl)-phenylmethyl]-4-methylpiperazine;hydrochloride | CAS Registry Number: 14362-31-3
Synonyms: CHLORCYCLIZINE HYDROCHLORIDE, Eramide, Perazil, CHLORCYCLIZINE HCl, Di-Paralene, Chlorcyclizinium chloride, Chlorcyclizine chloride, Chlorcyclizine monohydrochloride, 1620-21-9, EINECS 238-335-1, Mantadil, NSC 169496, (1-[(4-Chlorophenyl)phenyl-methyl]-4-methylpiperazine), 1-(p-Chlorobenzhydryl)-4-methylpiperazine monohydrochloride, 1-(p-Chloro-alpha-phenylbenzyl)-4-methylpiperazine monohydrochloride, Piperazine, 1-((4-chlorophenyl)phenylmethyl)-4-methyl-, monohydrochloride, Chlorcylizine, Prestwick_967, component of Fedrazil, Ah-289 hydrochloride

Molecular Formula: C18H22Cl2N2Molecular Weight: 337.286680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MSIJLVMSKDXAQN-UHFFFAOYSA-N

• Chlorogenic Acid
IUPAC Name: (1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid | CAS Registry Number: 327-97-9
Synonyms: Chlorogenate, CHLOROGENIC ACID, Hlorogenic acid, Heriguard, 3-Caffeoylquinic acid, 3-O-Caffeoylquinic acid, Prestwick_112, Caffeoyl quinic acid, Chlorogenic acid hemihydrate, CAS:, Chlorogenic acid (8CI), Prestwick2_000427, Prestwick3_000427, Spectrum5_000733, CCRIS 1400, BSPBio_000414, BSPBio_003353, SPECTRUM210800, MLS002153805, C3878_SIGMA

Molecular Formula: C16H18O9Molecular Weight: 354.308720 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 9

InChIKey: CWVRJTMFETXNAD-JUHZACGLSA-N

• Chloroquine phosphate
IUPAC Name: 4-N-(7-chloroquinolin-4-yl)-1-N,1-N-diethylpentane-1,4-diamine; phosphoric acid | CAS Registry Number: 50-63-5
Synonyms: Chingaminum, Quingamine, Alermine, Avloclor, Bemaphate, Chingamin, Khingamin, Miniquine, Resochin, Resoquine, Sanoquin, Tanakene, Arechin, Delagil, Tanakan, Aralen, Aralen phosphate, Chloroquine diphosphate, Nivaquine B, H-Stadur

Molecular Formula: C18H32ClN3O8P2Molecular Weight: 515.862502 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 11

InChIKey: QKICWELGRMTQCR-UHFFFAOYSA-N

• Choline chloride
IUPAC Name: 2-hydroxyethyl(trimethyl)azanium chloride | CAS Registry Number: 67-48-1
Synonyms: Hepacholine, Biocolina, Biocoline, Hormocline, Neocolina, Lipotril, Paresan, Luridin chloride, CHOLINE CHLORIDE, Cholinium chloride, Choline, chloride, Bilineurin chloride, Choline hydrochloride, Choline chlorhydrate, Chloride de choline, CHOLINE (CL), Colina cloruro [DCIT], Choline chloride [INN], Choline chloride solutions, Chloride de choline [French]

Molecular Formula: C5H14ClNOMolecular Weight: 139.623760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: SGMZJAMFUVOLNK-UHFFFAOYSA-M

• Cimetidine
IUPAC Name: 1-cyano-2-methyl-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine | CAS Registry Number: 51481-61-9
Synonyms: cimetidine, Tagamet, Cimetag, Cimetidina, Cimetidinum, Eureceptor, Gastrobitan, Ulcomedina, Acibilin, Dyspamet, Gastromet, Metracin, Ulcedine, Ulcerfen, Ulcestop, Valmagen, Cimetum, Edalene, Tametin, Ulcedin

Molecular Formula: C10H16N6SMolecular Weight: 252.339240 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: AQIXAKUUQRKLND-UHFFFAOYSA-N

• Cinnamaldehyde
IUPAC Name: (E)-3-phenylprop-2-enal | CAS Registry Number: 104-55-2
Synonyms: cinnamaldehyde, trans-Cinnamaldehyde, Phenylacrolein, Zimtaldehyde, Cinnamal, Cinnamic aldehyde, Cassia aldehyde, Cinnamylaldehyde, Cinnemaldehyde, 3-Phenylacrolein, 3-Phenylpropenal, (E)-Cinnamaldehyde, Cinnamyl aldehyde, beta-Phenylcrolein, Abion CA, beta-phenylacrolein, 3-Phenylacrylaldehyde, Cinnamaldehyde, (E)-, Benzylideneacetaldehyde, 2-Propenal, 3-phenyl-

Molecular Formula: C9H8OMolecular Weight: 132.159220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: KJPRLNWUNMBNBZ-QPJJXVBHSA-N

• Clofazimine
IUPAC Name: N,5-bis(4-chlorophenyl)-3-propan-2-yliminophenazin-2-amine | CAS Registry Number: 2030-63-9
Synonyms: clofazimine, Lamprene, Lampren, Chlofazimine, Clofazimina, Lamprene (TN), Prestwick_685, Clofaziminum [INN-Latin], B 663 (Pharmaceutical), Clofazimina [INN-Spanish], B 663, pharmaceutical, Prestwick0_000376, Prestwick1_000376, Prestwick2_000376, Prestwick3_000376, BSPBio_000531, MLS000028617, MLS001424318, C8895_SIGMA, Clofazimine (JAN/USP/INN)

Molecular Formula: C27H22Cl2N4Molecular Weight: 473.396380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: WDQPAMHFFCXSNU-UHFFFAOYSA-N

• Clopidogrel
IUPAC Name: methyl (2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetate | CAS Registry Number: 113665-84-2
Synonyms: clopidogrel, Plavix, (+)-Clopidogrel, Clopidogrel (TN), Clopidogrel (INN), Plavix (TN), Spectrum_000105, Clopidogrel [BAN:INN], Clopidogrel [INN:BAN], Spectrum2_000512, Spectrum3_001606, Spectrum4_000175, CLOPIDOGREL SULFATE, C16H16ClNO2S, BSPBio_003211, KBioGR_000689, KBioSS_000545, MLS001165708, MLS001195633, MLS001304711

Molecular Formula: C16H16ClNO2SMolecular Weight: 321.821740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: GKTWGGQPFAXNFI-HNNXBMFYSA-N

• Clopidogrel hydrogen sulfate
IUPAC Name: methyl (2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetate; sulfuric acid | CAS Registry Number: 120202-66-6
Synonyms: Plavix, Iscover, Clopidogrel bisulfate, Isocover, Isocover (TN), Clopidogrel hemisulfate, Plavix (TN), CLOPIDOGREL SULFATE, Clopidogrel hydrogensulfate, Clopidogrel Bisulfate [USAN], Clopidogrel sulfate (JAN), Clopidogrel bisulfate (USAN), SPECTRUM1503710, C16H16ClNO2S.H2O4S, SR 25990C, CID115366, PM-103, SR-25990C, DV-7314, LS-152396

Molecular Formula: C16H18ClNO6S2Molecular Weight: 419.900220 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: FDEODCTUSIWGLK-RSAXXLAASA-N

• Coluracetam
IUPAC Name: N-(2,3-dimethyl-5,6,7,8-tetrahydrofuro[2,3-b]quinolin-4-yl)-2-(2-oxopyrrolidin-1-yl)acetamide | CAS Registry Number: 135463-81-9
Synonyms: Coluracetam [INN], UNII-V6FL6O5GR7, CHEBI:152447, CID214346, N-(2,3-Dimethyl-5,6,7,8-tetrahydro-furo[2,3-b]quinolin-4-yl)-2-(2-oxo-pyrrolidin-1-yl)-acetamide, N-(2,3-Dimethyl-5,6,7,8-tetrahydrofuro(2,3-b)quinolin-4-yl)-2-(2-oxopyrrolidin-1-yl)acetamide

Molecular Formula: C19H23N3O3Molecular Weight: 341.404220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: PSPGQHXMUKWNDI-UHFFFAOYSA-N

• Concanavalin A (CAS: 11028-71-0)
• Corosolic acid
IUPAC Name: (1S,2R,4aS,6aR,6aS,6bR,10R,11R,12aR,14bR)-10,11-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid | CAS Registry Number: 4547-24-4
Synonyms: 2-alpha-Hydroxyursolic acid, LS-193275, Urs-12-en-28-oic acid, 2,3-dihydroxy-, (2alpha,3beta)-

Molecular Formula: C30H48O4Molecular Weight: 472.699720 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: HFGSQOYIOKBQOW-MMNUXRFXSA-N

• Cotinine
IUPAC Name: 1-methyl-5-pyridin-3-ylpyrrolidin-2-one | CAS Registry Number: 486-56-6
Synonyms: cotinine, Scotine, (-)-Cotinine, (S)-Cotinine, Cotinine [INN], (S)-(-)-Cotinine, Cotininum [INN-Latin], Cotinina [INN-Spanish], CCRIS 7625, C10H12N2O, EINECS 207-634-9, NIH 10498, BRN 0083099, 2-Pyrrolidinone, 1-methyl-5-(3-pyridinyl)-, (S)-, NCGC00093739-01, NCGC00093739-02, NCGC00093739-03, NCGC00093739-04, NCGC00093739-05, NCGC00093739-06

Molecular Formula: C10H12N2OMolecular Weight: 176.215080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: UIKROCXWUNQSPJ-UHFFFAOYSA-N

• CP-31398 dihydrochloride
IUPAC Name: N-[2-(1H-1,2,4-triazol-5-ylmethyl)-3,4-dihydro-1H-isoquinolin-6-yl]-2-[4-(trifluoromethyl)phenyl]benzamide | CAS Registry Number: 1217195-61-3
Synonyms: SureCN690395, SureCN7041135, N3-[2-[2-(4-Methoxyphenyl)ethenyl]-4-quinazolinyl]-N1,N1-dimethyl-1,3-propanediamine Hydrochloride Hydrate

Molecular Formula: C26H22F3N5OMolecular Weight: 477.480990 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: WNDIAFXQKOHFLV-UHFFFAOYSA-N

• CXD101
IUPAC Name: N-(2-aminophenyl)-4-[1-[(1,3-dimethylpyrazol-4-yl)methyl]piperidin-4-yl]benzamide | CAS Registry Number: 934828-12-3
Synonyms: HDAC-IN-4, UNII-5TNV87ICD2, 5TNV87ICD2, Hdac inhibitor CXD101, SCHEMBL4785187, CXD-101, JHDZMASHNBKTPS-UHFFFAOYSA-N, AZD-9468, EX-A1143, CXD101(AZD-9468), CXD101; AZD-9468, ZINC60328762, AKOS032944942, CS-5964, HY-100748, Benzamide, N-(2-aminophenyl)-4-(1-((1,3-dimethyl-1H-pyrazol-4-yl)methyl)-4-piperidinyl)-, N-(2-Aminophenyl)-4-{1-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]piperidin-4-yl}benzamide

Molecular Formula: C24H29N5OMolecular Weight: 403.530 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: JHDZMASHNBKTPS-UHFFFAOYSA-N

• Cyasterone
IUPAC Name: (3S,4S,5R)-4-[(2R,3R)-2,3-dihydroxy-3-[(2S,3R,5R,9R,10R,13R,14S,17S)-2,3,14-trihydroxy-10,13-dimethyl-6-oxo-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]butyl]-3,5-dimethyloxolan-2-one | CAS Registry Number: 17086-76-9
Synonyms: Cyasteron, Cyasteron; Cyasterone, CHEBI:29012, CID119444, LMST01040153, AI3-44890, LS-146756, C08816, 5-beta-Stigmast-7-en-26-oic acid, 2-beta,3-beta,14,20,22,28-hexahydroxy-6-oxo-, gamma-lactone, (22R,24S,25S,28R)-, Stigmast-7-en-26-oic acid, 2,3,14,20,22,28-hexahydroxy-6-oxo-, gamma-lactone (2beta,3beta,5beta,22R,24S,25S,28R)-, (22R,24S,25S,28R)-2beta,3beta,14,20,22-pentahydroxy-26,28-epoxy-5beta-stigmast-7-ene-6,26-dione

Molecular Formula: C29H44O8Molecular Weight: 520.654860 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 8

InChIKey: NEFYSBQJYCICOG-YSEUJXISSA-N

• Cyclohexyl Mercaptan
IUPAC Name: cyclohexanethiol | CAS Registry Number: 1569-69-3
Synonyms: CYCLOHEXANETHIOL, Cyclohexyl mercaptan, Cyclohexyl thiol, Cyclohexylthiol, Cyclohexylmercaptan, Cyklohexanthiol, Cyklohexylmerkaptan, Hexahydrothiophenol, Cyklohexanthiol [Czech], Cyklohexylmerkaptan [Czech], WLN: L6TJ ASH, HSDB 5840, C105600_ALDRICH, EINECS 216-378-7, NSC 59723, UN3054, CID15290, NSC59723, BRN 1236342, ZINC04619394

Molecular Formula: C6H12SMolecular Weight: 116.224480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: CMKBCTPCXZNQKX-UHFFFAOYSA-N

• Cyclopentolate Hydrochloride
IUPAC Name: 2-dimethylaminoethyl 2-(1-hydroxycyclopentyl)-2-phenylacetate hydrochloride | CAS Registry Number: 5870-29-1
Synonyms: Cyclogyl, Akpentolate, Pentolair, cyclopentolate, AK-Pentolate, Cicloplegicedol, Cyclomydril, Ciclolux, Cyplegin, Mydrilate, Zyklolat, Skiacol, Mixture Name, Cyclopentolate HCL, Cyclogyl (TN), CYCLOPENTOLATE HYDROCHLORIDE, C17H25NO3.HCl, MLS000069583, MLS001148637, MLS001332539

Molecular Formula: C17H26ClNO3Molecular Weight: 327.846240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: RHKZVMUBMXGOLL-UHFFFAOYSA-N

• Cyclothiazide
IUPAC Name: 3-(5-bicyclo[2.2.1]hept-2-enyl)-6-chloro-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide | CAS Registry Number: 2259-96-3
Synonyms: cyclothiazide, Anhydron, Ciclotiazida, Cyclothiazidum, Renazide, Valmiran, Aquirel, Doburil, Fluidil, Ciclotiazide, Ciclotiazide [DCIT], Anhydron (TN), Ciclotiazida [INN-Spanish], Cyclothiazidum [INN-Latin], Lilly 35,483, Spectrum4_000050, Spectrum5_001639, Ambmdy01503263, Biomol-NT_000224, MDi 193

Molecular Formula: C14H16ClN3O4S2Molecular Weight: 389.877540 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: BOCUKUHCLICSIY-UHFFFAOYSA-N

• D-AP5
IUPAC Name: (2R)-2-amino-5-phosphonopentanoic acid | CAS Registry Number: 79055-68-8
Synonyms: App acid, 5-Phosphono-D-norvaline, Tocris-0105, Tocris-0106, D-Norvaline, 5-phosphono-, Lopac-A-5282, A8054_SIGMA, D(-)-APV, D-2-Amino-5-phosphopentanoic acid, CHEBI:237121, MolPort-003-940-304, D-2-Amino-5-phosphonovaleric acid, 2-Amino-5-phosphono-pentanoic acid, CID135342, D(-)-AP-5, PDSP1_000129, PDSP2_000128, (R)-2-amino-5-phosphonopentanoicacid, (R)-2-Amino-5-phosphono-pentanoic acid, D(-)-2-Amino-5-phosphonopentanoic acid

Molecular Formula: C5H12NO5PMolecular Weight: 197.126241 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: VOROEQBFPPIACJ-SCSAIBSYSA-N

• D-Mannose
IUPAC Name: (3S,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol | CAS Registry Number: 3458-28-4
Synonyms: D-mannose, D-Mannopyranose, Carubinose, Seminose, mannose, DL-Mannose, Mannopyranose, D-, Mannose, D-, Mannose (VAN), nchembio828-comp8, (+)-Mannose, D(+)-Mannose, D-()-Mannose, D-(+)-Mannose, (+-)-Mannose, nchembio.151-comp3, MLS001332527, MLS001332528, M2069_SIGMA, M6020_SIGMA

Molecular Formula: C6H12O6Molecular Weight: 180.155880 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 6

InChIKey: WQZGKKKJIJFFOK-QTVWNMPRSA-N

• D-Serine
IUPAC Name: (2R)-2-amino-3-hydroxypropanoic acid | CAS Registry Number: 312-84-5
Synonyms: D-serine, serine, Serine D-form, L-serine, DL-Serine, D-Serin, L-ser, beta-Hydroxyalanine, 1pb8, nchembio.145-comp14, SERINE (L), Biomol-NT_000197, Lopac0_001088, S4250_SIGMA, BPBio1_001226, CHEBI:16523, EINECS 206-229-4, NSC 77689, AIDS071644, AIDS-071644

Molecular Formula: C3H7NO3Molecular Weight: 105.092580 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: MTCFGRXMJLQNBG-UWTATZPHSA-N

• D-Tyrosine
IUPAC Name: (2R)-2-amino-3-(4-hydroxyphenyl)propanoic acid | CAS Registry Number: 556-02-5
Synonyms: D-tyrosine, tyrosine, L-tyrosine, D-Tyrosin, (R)-3-(p-Hydroxyphenyl)alanine, 855456_ALDRICH, 3-(4-Hydroxyphenyl)-D-alanine, 93840_FLUKA, CHEBI:28479, EINECS 209-112-6, SBB012381, NCGC00142608-01, NCGC00142608-02, (R)-2-Amino-3-(p-hydroxyphenyl)propionic acid, C06420, T-9000, (R)-2-Amino-3-(4-hydroxyphenyl)propionic acid, (2R)-2-amino-3-(4-hydroxyphenyl)propanoic acid, 60-18-4, InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13

Molecular Formula: C9H11NO3Molecular Weight: 181.188540 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: OUYCCCASQSFEME-MRVPVSSYSA-N

• DAPT
IUPAC Name: tert-butyl (2S)-2-[[(2S)-2-[[2-(3,5-difluorophenyl)acetyl]amino]propanoyl]amino]-2-phenylacetate | CAS Registry Number: 208255-80-5
Synonyms: dapt, DAPT (GSI-IX), gamma-Secretase Inhibitor IX, DAPT, GSI-IX, InSolution™ gamma-Secretase Inhibitor IX, N-[N-(3,5-Difluorophenacetyl-L-alanyl)]-S-phenylglycine t-Butyl Ester, GSIIX, S2215_Selleck, AC1NSKCB, PubChem22436, GSI IX, GSI-IX, DAPT,GSI-IX, DAPT - GSI-IX, SureCN1360313, cc-201, CHEMBL255682, QCR-29, DAPT-Supplied by Selleck Chemicals, ABP000317

Molecular Formula: C23H26F2N2O4Molecular Weight: 432.460346 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: DWJXYEABWRJFSP-XOBRGWDASA-N

• Darifenacin hydrobromide
IUPAC Name: 2-[(3S)-1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl]-2,2-diphenylacetamide hydrobromide | CAS Registry Number: 133099-07-7
Synonyms: Enablex, Emselex, Enablex (TN), UK 88525-04 hydrobromide, CID444030, Darifenacin hydrobromide (JAN/USAN), UK-88525, LS-186532, UK-88525-04, D01699, 3-Pyrrolidineacetamide, 1-(2-(2,3-dihydro-5-benzofuranyl)ethyl)-alpha,alpha-diphenyl-, monohydrobromide, (S)-, (S)-2-{1-(2-(2,3-Dihydrobenzofuran-5-yl)ethyl)-3-pyrrolidnyl}-2,2-diphenylacetamide hydrobromide, 3-Pyrrolidineacetamide, 1-(2-(2,3-dihydro-5-benzofuranyl)ethyl)-alpha,alpha-diphenyl-, monohydrobromide, (3S)-

Molecular Formula: C28H31BrN2O2Molecular Weight: 507.461940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UQAVIASOPREUIT-VQIWEWKSSA-N

• Darusentan
IUPAC Name: (2S)-2-(4,6-dimethoxypyrimidin-2-yl)oxy-3-methoxy-3,3-di(phenyl)propanoic acid | CAS Registry Number: 171714-84-4
Synonyms: Lu 135252, HMR-4005, LU-135252, LS-31102, LU135252, LU 127043, C107831, 2-(4,6-dimethoxypyrimidin-2-yloxy)-3-methoxy-3,3-diphenylpropionic acid, Benzenepropanoic acid, alpha-((4,6-dimethoxy-2-pyrimidinyl)oxy)-beta-methoxy-beta-phenyl-, (alphaS)-, Benzenepropanoic acid, alpha-((4,6-dimethoxy-2-pyrimidinyl)oxy)-beta-methoxy-beta-phenyl-, (S)-, (+)-(S)-2-((4,6-Dimethoxy-2-pyrimidinyl)oxy)-3-methoxy-3,3-diphenylpropionic acid, 177036-80-5

Molecular Formula: C22H22N2O6Molecular Weight: 410.419880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: FEJVSJIALLTFRP-LJQANCHMSA-N

• Decanoic Acid
IUPAC Name: decanoic acid | CAS Registry Number: 334-48-5
Synonyms: Decanoic acid, n-Capric acid, CAPRIC ACID, n-Decanoic acid, Caprinic acid, Decylic acid, Decoic acid, Caprynic acid, decanoate, n-Decylic acid, n-Decoic acid, caprate, caprinate, Dekansaeure, Kaprinsaeure, n-decanoate, Sodium caprate, Versatic 10, C10 fatty acid, Versatic 10 acid

Molecular Formula: C10H20O2Molecular Weight: 172.264600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GHVNFZFCNZKVNT-UHFFFAOYSA-N

• Demethylmurrayanine
IUPAC Name: 1-hydroxy-9H-carbazole-3-carbaldehyde | CAS Registry Number: 123497-84-7
Synonyms: CHEBI:69932, 1-Hydroxy-9H-carbazole-3-carbaldehyde, 1-Hydroxy-3-formyl-9H-carbazol, O-demethylmurrayanine, AC1LD2ZR, CHEMBL479681, SCHEMBL11960245, OYSFFQUIYNEZKX-UHFFFAOYSA-N, 1-Hydroxy-9H-carbazole-3-carboxaldehyde, 1-Hydroxy-9H-carbazole-3-carbaldehyde #

Molecular Formula: C13H9NO2Molecular Weight: 211.216060 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: OYSFFQUIYNEZKX-UHFFFAOYSA-N

• Deoxyarbutin
IUPAC Name: 4-(oxan-2-yloxy)phenol | CAS Registry Number: 53936-56-4
Synonyms: 4-((Tetrahydro-2H-pyran-2-yl)oxy)phenol, 4-(Tetrahydro-2H-pyran-2-yloxy)phenol, Phenol, 4-((tetrahydro-2H-pyran-2-yl)oxy)-, Phenol, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-, Girlite DA 100, Tetrahydropyranyloxy phenol, AGN-PC-00ASLE, SureCN222919, UNII-RG969BY5EN, (+/-)-Tetrahydropyranyloxy phenol, Tetrahydropyranyloxy phenol [INCI], 4-((2-Tetrahydropyranyl)oxy)phenol, ANW-48655, Tetrahydropyranyloxy phenol, (+/-)-, 4-(tetrahydro-2H-2-pyranyloxy)phenol, AKOS015919608, 4-Hydroxyphenyl tetrahydropyranyl ether, AK-77741, BR-77741, KB-71706

Molecular Formula: C11H14O3Molecular Weight: 194.227060 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GFBCWCDNXDKFRH-UHFFFAOYSA-N

• Dichlorphenamide
IUPAC Name: 4,5-dichlorobenzene-1,3-disulfonamide | CAS Registry Number: 120-97-8
Synonyms: dichlorphenamide, Diclofenamide, Dichlofenamide, Dichlorphenamid, Daranide, Dichlorophenamide, Antidrasi, Glaucol, Oratrol, Barastonin, Diclofenamid, Glauconide, Fenamide, Glajust, Glaumid, Glafco, 2pou, Daranide (TN), Prestwick_1071, Dichlorphenamide [BAN]

Molecular Formula: C6H6Cl2N2O4S2Molecular Weight: 305.158840 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: GJQPMPFPNINLKP-UHFFFAOYSA-N

• Diethylmaleate
IUPAC Name: diethyl (Z)-but-2-enedioate | CAS Registry Number: 141-05-9
Synonyms: Ethyl maleate, DIETHYL MALEATE, Maleic acid, diethyl ester, diethyl but-2-enedioate, Maleic acid diethyl ester, diethyl (2Z)-but-2-enedioate, CCRIS 941, D97703_ALDRICH, WLN: 2OV1U1VO2, 2-Butenedioic acid (Z)-, diethyl ester, (C8-C15) Dialkyl maleates, W505005_ALDRICH, NSC 8394, C20-C24 Fatty alcohol maleate, EINECS 205-451-9, NSC8394, AIDS208584, AIDS-208584, Diethylester kyseliny maleinove [Czech], BRN 1100825

Molecular Formula: C8H12O4Molecular Weight: 172.178480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: IEPRKVQEAMIZSS-WAYWQWQTSA-N

• Diethyltoluamide
IUPAC Name: N,N-diethyl-3-methylbenzamide | CAS Registry Number: 134-62-3
Synonyms: DEET, Metadelphene, Dieltamid, Delphene, Detamide, N,N-Diethyl-m-toluamide, Flypel, Autan, Repudin-Special, m-Delphene, Diethyl toluamide, Muscol, Naugatuck DET, Repel, Repper-DET, DETA, Diethyl-m-toluamide, M-Det, Bepper DET, Repper DET

Molecular Formula: C12H17NOMolecular Weight: 191.269480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: MMOXZBCLCQITDF-UHFFFAOYSA-N

• Dihydroergocristine mesylate
Synonyms: Diertine, Dihydroergocristine, Diertine (TN), Prestwick_745, Dihydroergocristine mesilate, D155_SIGMA, DIHYDROERGOCRISTINE MESYLATE, MLS000069354, MLS001076298, MLS001333686, MLS002222256, MolPort-000-763-385, Dihydroergocristine methanesulfonate, HMS1569B06, PHAR094403, Dihydroergocristine mesilate (BAN), CID444034, Dihydroergocristine methanesulfonate salt, NCGC00025380-03, SMR000058240

Molecular Formula: C36H45N5O8SMolecular Weight: 707.836200 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 9

InChIKey: SPXACGZWWVIDGR-SPZWACKZSA-N

• Dihydromyrcene
IUPAC Name: 3,7-dimethylocta-1,6-diene | CAS Registry Number: 2436-90-0
Synonyms: Citronellene, DIHYDROMYRCENE, 3,7-Dimethyl-1,6-octadiene, 3,7-Dimethylocta-1,6-diene, 1,6-Octadiene, 3,7-dimethyl-, EINECS 219-433-3, R(-)3,7-Dimethyl-1,6-octadiene, LS-97783, 1,6-Octadiene, 3,7-dimethyl-, (S)-, 128241-35-0

Molecular Formula: C10H18Molecular Weight: 138.249920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: FUDNBFMOXDUIIE-UHFFFAOYSA-N

• Diminazene Aceturate
IUPAC Name: 2-acetamidoacetic acid; 4-[2-(4-carbamimidoylphenyl)iminohydrazinyl]benzenecarboximidamide | CAS Registry Number: 908-54-3
Synonyms: Diminazene diaceturate, N-acetylglycine - 4-[(1E)-3-{4-[amino(imino)methyl]phenyl}triaz-1-en-1-yl]benzenecarboximidamide (2:1)

Molecular Formula: C22H29N9O6Molecular Weight: 515.522360 [g/mol]
H-Bond Donor: 9H-Bond Acceptor: 13

InChIKey: OKQSSSVVBOUMNZ-UHFFFAOYSA-N

• Diphenylmethane
IUPAC Name: phenylmethylbenzene | CAS Registry Number: 101-81-5
Synonyms: Benzylbenzene, Ditan, Ditane, Benzyl benzene, Benzene, benzyl-, Diphenyl methane, Diphenylmethan, Diphenylmethyl, Methane, diphenyl-, Methylenedibenzene, alpha-phenyltoluene, Benzene, 1,1'-methylenebis-, (phenylmethyl)benzene, Benzene, (phenylmethyl)-, Toluene, alpha-phenyl-, Diphenylmethyl radical, 1,1'-methylenedibenzene, 1,1'-Dimethylenebis(benzene), Toluene, .alpha.-phenyl-, 1,1'-METHYLENEBISBENZENE

Molecular Formula: C13H12Molecular Weight: 168.234380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: CZZYITDELCSZES-UHFFFAOYSA-N

• Diprotin A
IUPAC Name: 1-(2-amino-3-methylpentanoyl)-N-(3-methyl-1-oxopentan-2-yl)pyrrolidine-2-carboxamide | CAS Registry Number: 90614-48-5
Synonyms: Ile-Pro-Ile, PRO01, IPI

Molecular Formula: C17H31N3O3Molecular Weight: 325.446340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: KHRSTJDHVMBJRG-UHFFFAOYSA-N


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