Nanjing King-Pharm Co., Ltd.

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Profile: Nanjing King-Pharm Co., Ltd. is a manufacturer of chemical, agrochemical, organic and pharmaceutical intermediates. We also offer active pharmaceutical ingredients and electronic chemicals. Our products include diethyl oxaloacetate, 5-amino-2-methoxypyridine, 4-hydroxyisophthalic acid, 4-iodobiphenyl, N,N'-diphenylbenzidine, 4,4'-diiodobiphenyl, 4-bromotriphenylamine and 1-bromo-3-iodobenzene.

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• Phenylacetyl disulphide

IUPAC Name: S-(2-phenylacetyl)sulfanyl 2-phenylethanethioate | CAS Registry Number: 15088-78-5
Synonyms: Phenylacetyl disulfide, CBDivE_012388, 554324_ALDRICH, ZINC04352620

Molecular Formula:	C₁₆H₁₄O₂S₂	Molecular Weight:	302.411160 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: IXGZXXBJSZISOO-UHFFFAOYSA-N

• Phenylmalonic Acid

IUPAC Name: 2-phenylpropanedioic acid | CAS Registry Number: 2613-89-0
Synonyms: Phenylmalonic acid, 2-Phenylmalonic acid, Malonic acid, phenyl-, Propanedioic acid, phenyl-, Ambap2995, 1o4p, 2-phenylpropanedioic acid, PHENYL MALONIC ACID, alpha-Carboxyphenylacetic acid, 160369_ALDRICH, Malonic acid, phenyl- (8CI), .alpha.-Carboxyphenylacetic acid, RU78191, CID75791, NSC27164, NSC41697, EINECS 220-044-6, NSC 27164, NSC 41697, Toluene-alpha,alpha-dicarboxylic acid

Molecular Formula:	C₉H₈O₄	Molecular Weight:	180.157420 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: WWYDYZMNFQIYPT-UHFFFAOYSA-N

• Phosphonitrilic chloride trimer

IUPAC Name: 1,1,3,3,5,5-hexachloro-2,4,6-triaza-1$l^{5},3$l^{5},5$l^{5}-triphosphacyclohexa-1,3,5-triene | CAS Registry Number: 940-71-6
Synonyms: Hexachlorophosphazene, Hexachlorocyclotriphosphazene, Triphosphonitrile chloride, Hexachlorotriphosphonitrile, Triphosphonitrilic chloride, Cyclophosphazene dichloride trimer, Hexachlorocyclophosphazatriene, Dichlorocyclophosphazine trimer, Hexachlorocyclotriphosphazine, Hexachlorocyclotriphosphazatriene, Phosphononitrilic chloride trimer, NSC2667, 230286_ALDRICH, 481947_ALDRICH, Cyclophosphonitrilic chloride trimer, NSC209799, Phosphonitrilic chloride cyclic trimer, AIDS011557, Phosphonitrile chloride, cyclic trimer, AIDS-011557

Molecular Formula:	Cl₆N₃P₃	Molecular Weight:	347.659383 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: UBIJTWDKTYCPMQ-UHFFFAOYSA-N

• Phthalocyanine Tin(iv) Dichloride

Synonyms: CID9589406, Tin, dichloro(29H,31H-phthalocyaninato(2-)-kappaN29,kappaN30,kappaN31,kappaN32)-, (OC-6-12)-, 190391-73-2

Molecular Formula:	C₃₂H₁₆Cl₂N₈Sn	Molecular Weight:	702.139040 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	7

InChIKey: BBRNKSXHHJRNHK-UHFFFAOYSA-L

• Picolinic Acid

IUPAC Name: pyridine-2-carboxylic acid | CAS Registry Number: 98-98-6
Synonyms: picolinic acid, 2-Carboxypyridine, 2-Pyridinecarboxylic acid, Nicogamol, Nikogamol, picolinate, 2-Picolinic acid, alpha-Picolinic acid, o-Pyridinecarboxylic acid, Pyridine-2-carboxylic acid, 2-pyridinecarboxylate, alpha-Pyridinecarboxylic acid, Acide picolique [French], 2-pyridine carboxylic acid, Oprea1_485360, P42800_ALDRICH, MLS001335931, MLS001335932, PYRIDINECARBOXYLIC ACID, NSC 171

Molecular Formula:	C₆H₅NO₂	Molecular Weight:	123.109400 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: SIOXPEMLGUPBBT-UHFFFAOYSA-N

• Piperine

IUPAC Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one | CAS Registry Number: 94-62-2
Synonyms: piperine, 1-Piperoylpiperidine, Piperin, Bioperine, Piperoylpiperidine, Piperine (aliphatic), 1-Piperoyl-piperidine, Prestwick_398, piperine, (E,E)-isomer, Prestwick2_000474, Prestwick3_000474, Spectrum5_001507, piperine, (E,Z)-isomer, piperine, (Z,E)-isomer, piperine, (Z,Z)-isomer, FEMA No. 2909, CCRIS 5572, N-[(E,E)-Piperoyl]piperidine, (E,E)-1-piperoylpiperidine, 1-Piperoylpiperidine, (E,E)-

Molecular Formula:	C₁₇H₁₉NO₃	Molecular Weight:	285.337660 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: MXXWOMGUGJBKIW-YPCIICBESA-N

• Podophyllotoxin

IUPAC Name: (5R,5aR,8aR,9R)-5-hydroxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one | CAS Registry Number: 518-28-5
Synonyms: podophyllotoxin, Podofilox, Condylox, Condyline, Wartec, Warticon, Podophyllotoxin 7, Mayapple isolate, Epipodophyllotoxin, Podofilox [USAN], Podophyllinic acid lactone, Condylox (TN), Podofilox (USAN), Prestwick_1018, (-)-Podophyllotoxin, Podophyllotoxin (BAN), Spectrum_000199, Podophyllotoxin (8CI), Prestwick0_000782, Prestwick1_000782

Molecular Formula:	C₂₂H₂₂O₈	Molecular Weight:	414.405280 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	8

InChIKey: YJGVMLPVUAXIQN-XVVDYKMHSA-N

• Polydatin

IUPAC Name: (2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol | CAS Registry Number: 27208-80-6
Synonyms: Piceid, Ambap3820, 3,4,5-Tsg, MLS000759499, MLS001424114, 572691_ALDRICH, Resveratrol 3-beta-mono-D-glucoside, AIDS070480, AIDS-070480, CID5281718, 3,5,4'-Trihydroxystilbene 3-glucoside, CPD000466371, SAM001246720, SMR000466371, 3,4,5-Trihydroxystilbene-3-beta-monoglucoside, C10275, 3,4'-5-Trihydroxystilbene-3-beta-D-glucopyranoside, 3-Hydroxy-5-(2-(4-hydroxyphenyl)ethenyl)phenyl-beta-D-glucoside, beta-D-Glucopyranoside, 3-hydroxy-5-(2-(4-hydroxyphenyl)ethenyl)phenyl, beta-D-Glucopyranoside, 3-hydroxy-5-(2-(4-hydroxyphenyl)ethenyl)phenyl-, (E)-

Molecular Formula:	C₂₀H₂₂O₈	Molecular Weight:	390.383880 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	8

InChIKey: HSTZMXCBWJGKHG-CUYWLFDKSA-N

• Polydatin

IUPAC Name: (2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol | CAS Registry Number: 65914-17-2
Synonyms: Piceid, Ambap3820, 3,4,5-Tsg, MLS000759499, MLS001424114, 572691_ALDRICH, Resveratrol 3-beta-mono-D-glucoside, AIDS070480, AIDS-070480, CID5281718, 3,5,4'-Trihydroxystilbene 3-glucoside, CPD000466371, SAM001246720, SMR000466371, 3,4,5-Trihydroxystilbene-3-beta-monoglucoside, C10275, 3,4'-5-Trihydroxystilbene-3-beta-D-glucopyranoside, 27208-80-6, 3-Hydroxy-5-(2-(4-hydroxyphenyl)ethenyl)phenyl-beta-D-glucoside, beta-D-Glucopyranoside, 3-hydroxy-5-(2-(4-hydroxyphenyl)ethenyl)phenyl

Molecular Formula:	C₂₀H₂₂O₈	Molecular Weight:	390.383880 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	8

InChIKey: HSTZMXCBWJGKHG-CUYWLFDKSA-N

• Potassium monoethyl malonate

IUPAC Name: 3-ethoxy-3-oxopropanoate | CAS Registry Number: 6148-64-7
Synonyms: ZINC00389716, CID3595298

Molecular Formula:	C₅H₇O₄-	Molecular Weight:	131.106680 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: HGINADPHJQTSKN-UHFFFAOYSA-M

• Propiolic acid methyl ester

IUPAC Name: methyl prop-2-ynoate | CAS Registry Number: 922-67-8
Synonyms: Methyl propynoate, METHYL PROPIOLATE, Methyl ethynecarboxylate, Methyl acetylenecarboxylate, Propiolic acid, methyl ester, 2-Propynoic acid, methyl ester, Propynoic acid, methyl ester, 171859_ALDRICH, 81863_FLUKA, EINECS 213-083-5, Acetylenecarboxylic acid methyl ester, NSC 154164, ALBB-008926, BRN 0605462, NSC154164, ZINC01564788, AI3-37828, 2-Propynoic acid, methyl ester (9CI), SB 01817, LS-123962

Molecular Formula:	C₄H₄O₂	Molecular Weight:	84.073360 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: IMAKHNTVDGLIRY-UHFFFAOYSA-N

• Puerarin

IUPAC Name: 7-hydroxy-3-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one | CAS Registry Number: 3681-99-0
Synonyms: NPI-31G, P5555_SIGMA, 82435_FLUKA, CID5281807, C10524, 8-(beta-D-Glucopyranosyl-7-hydroxy-3- (4-hydroxyphenyl)-4H-1-benzopyran-4-one

Molecular Formula:	C₂₁H₂₀O₉	Molecular Weight:	416.378100 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	9

InChIKey: HKEAFJYKMMKDOR-VPRICQMDSA-N

• Quercetin Dihydrate

IUPAC Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one dihydrate | CAS Registry Number: 6151-25-3
Synonyms: Quercetin dihydrate, Quercetine dihydrate, Prestwick_541, Quercetin, Dihydrate, QUERCITRIN DIHYDRATE, CCRIS 3304, CID5284452, LS-1471, NCGC00017056-01, CAS-6151-25-3, ST5309238, Flavone, 3,3',4',5,7-pentahydroxy-, dihydrate, 3,3′,4′,5,7-Pentahydroxyflavone, 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one dihydrate, QUERCETIN DIHYDRATE (SEE ALSOQUERCETIN (117-39-5))

Molecular Formula:	C₁₅H₁₄O₉	Molecular Weight:	338.266260 [g/mol]
H-Bond Donor:	7	H-Bond Acceptor:	9

InChIKey: GMGIWEZSKCNYSW-UHFFFAOYSA-N

• Resveratrol

IUPAC Name: 5-[(E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol | CAS Registry Number: 501-36-0
Synonyms: resveratrol, trans-resveratrol, (E)-resveratrol, 3,4',5-Stilbenetriol, 3,4',5-Trihydroxystilbene, Prestwick_619, 3,5,4'-Trihydroxystilbene, nchembio.140-comp2, Prestwick2_000508, Prestwick3_000508, Spectrum5_000552, Lopac0_001111, BSPBio_000435, BSPBio_001114, BSPBio_003461, 3,4',5-trihydroxy-stilbene, MLS000069735, MLS001055357, MLS001076538, R5010_SIGMA

Molecular Formula:	C₁₄H₁₂O₃	Molecular Weight:	228.243280 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: LUKBXSAWLPMMSZ-OWOJBTEDSA-N

• Rhein

IUPAC Name: 4,5-dihydroxy-9,10-dioxoanthracene-2-carboxylic acid | CAS Registry Number: 478-43-3
Synonyms: Rhubarb Yellow, Monorhein, Cassic acid, Rheic acid, dipropionyl rhein, Chrysazin-3-carboxylic acid, CCRIS 5129, MLS000069639, R7269_SIGMA, 275611_ALDRICH, MEGxp0_001866, ACon1_000217, EINECS 207-521-4, C15H8O6, 4,5-DiOH-anthraquinone-2-COOH, NSC 38629, AIDS001379, 4,5-Dihydroxyanthraquinone-2-carboxylic acid, AIDS-001379, NSC38629

Molecular Formula:	C₁₅H₈O₆	Molecular Weight:	284.220420 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: FCDLCPWAQCPTKC-UHFFFAOYSA-N

• Roxithromycin

IUPAC Name: (2R,3S,4S,5R,6R,8R,9E,10S,11R,12S,13R)-5-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-13-ethyl-6,11,12-trihydroxy-3-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-9-(2-methoxyethoxymethoxyimino)-2,4,6,8,10,12-hexamethyl-14-oxacyclotetradecan-1-one | CAS Registry Number: 80214-83-1
Synonyms: roxithromycin, Rulide, Prestwick_1046, Roxithromycine [French], Roxithromycinum [Latin], Roxitromicina [Spanish], Prestwick2_000854, CCRIS 3461, Roxithromycin [USAN:INN:JAN], RU 965, AIDS208769, AIDS-208769, C41H76N2O15, BRN 4286925, RU-965, RU 28965, CID9567573, Roxithromycin plus Tumor Necrosis Factor, LS-64684, RU-28965

Molecular Formula:	C₄₁H₇₆N₂O₁₅	Molecular Weight:	837.046540 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	17

InChIKey: RXZBMPWDPOLZGW-KMAKEOJNSA-N

• Serotonin Hcl

IUPAC Name: 3-(2-aminoethyl)-1H-indol-5-ol hydrochloride | CAS Registry Number: 153-98-0
Synonyms: Serotonin hydrochloride, Prestwick_447, 5-Hydroxytryptamine hydrochloride, CCRIS 4420, MLS001332607, MLS001332608, MLS002153834, H9523_SIGMA, 5-HT, SBB003418, NCGC00093982-01, NCGC00093982-02, LS-83659, SMR000875214, EU-0100607, 3-(2-Aminoethyl)-5-hydroxyindole hydrochloride, H-8140, 1H-Indol-5-ol, 3-(2-aminoethyl)-, monohydrochloride

Molecular Formula:	C₁₀H₁₃ClN₂O	Molecular Weight:	212.676020 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	3

InChIKey: MDIGAZPGKJFIAH-UHFFFAOYSA-N

• Shikimic Acid

IUPAC Name: (3R,4S,5R)-3,4,5-trihydroxycyclohexene-1-carboxylic acid | CAS Registry Number: 138-59-0
Synonyms: shikimic acid, shikimate, L-Shikimic acid, 2aay, (-)-Shikimic acid, Bracken fern toxic component, Spectrum_001232, 1we2, 2aa9, SpecPlus_000488, Spectrum2_001508, Spectrum3_001541, Spectrum4_001853, Spectrum5_000386, CCRIS 7681, HSDB 3537, BSPBio_002982, KBioGR_002287, KBioSS_001712, DivK1c_006584

Molecular Formula:	C₇H₁₀O₅	Molecular Weight:	174.151300 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	5

InChIKey: JXOHGGNKMLTUBP-HSUXUTPPSA-N

• Silymarin (Milk Thistle)

IUPAC Name: (2R,3R)-3,5,7-trihydroxy-2-[(2S,3S)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-7-yl]-2,3-dihydrochromen-4-one | CAS Registry Number: 65666-07-1
Synonyms: Silybin, SILYMARIN, Silymarin + Melatonin, ZINC01530850, CID1548994, (2R,3R)-3,5,7-trihydroxy-2-[(2S,3S)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydro-4H-chromen-4-one

Molecular Formula:	C₂₅H₂₂O₁₀	Molecular Weight:	482.436180 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	10

InChIKey: SEBFKMXJBCUCAI-WAABAYLZSA-N

• Sinomenine

Synonyms: Cucoline, Kukoline, Coculine, cuculine, Sabianine A, COCCULINE, Spectrum2_001242, Spectrum3_001134, Spectrum4_001981, Spectrum5_001621, UPCMLD-DP085, sinomenine A bismethyliodide, CCRIS 1550, BSPBio_002627, KBioGR_002508, SPECTRUM1505253, SPBio_001144, 365602_ALDRICH, STOCK1N-06056, UPCMLD-DP085:001

Molecular Formula:	C₁₉H₂₃NO₄	Molecular Weight:	329.390220 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: INYYVPJSBIVGPH-QHRIQVFBSA-N

• Sodium Valproate

IUPAC Name: sodium 2-propylpentanoate | CAS Registry Number: 1069-66-5
Synonyms: Sodium valproate, Valproate sodium, Depakene, Epilim, Convulex, Eurekene, Labazene, Orfiril, Valerin, Natrium valproat, Selenica, Sodium 2-propylpentanoate, Valproic acid sodium salt, Dipropylacetate sodium, Sodium dipropylacetate, Depakene (TN), Selenica (TN), Sodium bispropylacetate, Valproic acid sodium, Valproinsaeure, natrium

Molecular Formula:	C₈H₁₅NaO₂	Molecular Weight:	166.193270 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: AEQFSUDEHCCHBT-UHFFFAOYSA-M

• Tanshinone IIA

IUPAC Name: 1,6,6-trimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione | CAS Registry Number: 568-72-9
Synonyms: Tanshinon II, Tanshinone B, Tanshinone II, Dan Shen Ketone, Tanshinone ?A, tanshinone II A, Ambap896, BSPBio_001597, BSPBio_002426, KBioGR_000317, KBioSS_000317, MLS001048863, SPECTRUM1505824, KBio2_000317, KBio2_002885, KBio2_005453, KBio3_000633, KBio3_000634, NSC686519, AIDS150197

Molecular Formula:	C₁₉H₁₈O₃	Molecular Weight:	294.344420 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: HYXITZLLTYIPOF-UHFFFAOYSA-N

• Tetraethyl thiuram disulfide

IUPAC Name: diethylcarbamothioylsulfanyl N,N-diethylcarbamodithioate | CAS Registry Number: 97-77-8
Synonyms: disulfiram, Antabuse, Alcophobin, Anticol, Teturam, Tetraethylthiuram disulfide, Dicupral, Antabus, Esperal, Refusal, Ethyldithiurame, Antietanol, Antivitium, Thiuranide, Abstensil, Antaethyl, Contralin, Tetradine, Tetraetil, Teturamin

Molecular Formula:	C₁₀H₂₀N₂S₄	Molecular Weight:	296.539200 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: AUZONCFQVSMFAP-UHFFFAOYSA-N

• Tetrahydrofuran

IUPAC Name: oxolane | CAS Registry Number: 109-99-9
Synonyms: Furanidine, TETRAHYDROFURAN, Oxolane, Butylene oxide, Oxacyclopentane, Hydrofuran, Furan, tetrahydro-, Tetramethylene oxide, Diethylene oxide, 1,4-Epoxybutane, Tetraidrofurano, Agrisynth THF, Tetrahydrofuraan, Cyclotetramethylene, Tetrahydrofuranne, Cyclotetramethylene oxide, Polytetrahydrofuran, Butane, 1,4-epoxy-, Tetrahydrofuraan [Dutch], Tetraidrofurano [Italian]

Molecular Formula:	C₄H₈O	Molecular Weight:	72.105720 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: WYURNTSHIVDZCO-UHFFFAOYSA-N

• Tetraphenylbenzidine

IUPAC Name: N,N-di(phenyl)-4-[4-(N-phenylanilino)phenyl]aniline | CAS Registry Number: 15546-43-7
Synonyms: Tetra-N-phenylbenzidine, 658812_ALDRICH, N,N,N',N'-Tetraphenylbenzidine, N,N,N1,N1-Tetraphenylbenzidine, EINECS 239-599-0, BAS 00295759, ST5221850, N,N,N',N'-Tetraphenyl(1,1'-biphenyl)-4,4'-diamine, (1,1'-Biphenyl)-4,4'-diamine, N,N,N',N'-tetraphenyl-, N*4*,N*4*,N*4'*,N*4'*-Tetraphenyl-biphenyl-4,4'-diamine, TPB

Molecular Formula:	C₃₆H₂₈N₂	Molecular Weight:	488.620920 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: DCZNSJVFOQPSRV-UHFFFAOYSA-N

• Thidiazuron

IUPAC Name: 1-phenyl-3-(thiadiazol-5-yl)urea | CAS Registry Number: 51707-55-2
Synonyms: Defolit, Dropp, THIDIAZURON, Caswell No. 659A, PS2044_SUPELCO, Thidiazuron [ANSI:BSI:ISO], P6186_SIGMA, 45686_RIEDEL, EINECS 257-356-7, EPA Pesticide Chemical Code 120301, CID40087, BRN 1078092, N-Phenyl-N'-1,2,3-thiazol-5-ylurea, 1-Phenyl-3-(1,2,3-thiadiazol-5-yl)urea, ZINC00073715, SN 49537, N-Phenyl-N'-1,2,3-thiadiazol-5-ylurea, (N-1,2,3-Thiadiazolyl-5)-N'-phenylurea, N-Phenyl-N'-1,2,3-thiadiazol-5-yl-urea, NCGC00160490-01

Molecular Formula:	C₉H₈N₄OS	Molecular Weight:	220.251020 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: HFCYZXMHUIHAQI-UHFFFAOYSA-N

• 2-Aminodiphenylamine

IUPAC Name: 1-N-phenylbenzene-1,2-diamine | CAS Registry Number: 534-85-0
Synonyms: o-Semidine, o-Aminodiphenylamine, N-Phenyl-o-phenylenediamine, o-Phenylenediamine, N-phenyl-, 1,2-Benzenediamine, N-phenyl-, Oprea1_641461, P28352_ALDRICH, MLS000567679, AIDS167122, AIDS-167122, NSC18731, NSC33960, EINECS 208-606-9, NSC 18731, SBB000244, ZINC00058285, o-Phenylenediamine, N-phenyl- (8CI), C.I. 50005, SMR000154191

Molecular Formula:	C₁₂H₁₂N₂	Molecular Weight:	184.237080 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: NFCPRRWCTNLGSN-UHFFFAOYSA-N

• 4-hydroxy-2'-nitrodiphenylamine

IUPAC Name: 4-(2-nitroanilino)phenol | CAS Registry Number: 54381-08-7
Synonyms: HC Orange no. 1, 4-(2-nitroanilino)benzenol, p-((o-Nitrophenyl)amino)phenol, 2-Nitro-4'-hydroxydiphenylamine, MLS000736169, 4-((2-Nitrophenyl)amino)phenol, EINECS 259-132-4, Phenol, 4-((2-nitrophenyl)amino)-, ZINC04054876, MS-3693, SMR000338719, LS-104995

Molecular Formula:	C₁₂H₁₀N₂O₃	Molecular Weight:	230.219400 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: HSDSBIUUVWRHTM-UHFFFAOYSA-N

• 2-Acetamido-cinnamic acid

IUPAC Name: (E)-2-acetamido-3-phenylprop-2-enoic acid | CAS Registry Number: 5469-45-4
Synonyms: 1-Acetamidocinnamic acid, alpha-Acetamidocinnamic acid, alpha-Acetaminocinnamic acid, AIDS018380, AIDS-018380, NSC25333, EINECS 226-795-6, SBB015215, 2-(acetylamino)-3-phenylacrylic acid, PB271082100, A-0205, AE-641/01171036

Molecular Formula:	C₁₁H₁₁NO₃	Molecular Weight:	205.209940 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: XODAOBAZOQSFDS-JXMROGBWSA-N

• 2-Methyl-5-hydroxyethylaminophenol

IUPAC Name: 5-(2-hydroxyethylamino)-2-methylphenol | CAS Registry Number: 55302-96-0
Synonyms: CCRIS 3162, EINECS 259-583-7, 5-((2-Hydroxyethyl)amino)-o-cresol, 6-Methyl-3-beta-hydroxyethylaminophenol, 5-((2-Hydroxyethyl)amino)-2-methylphenol, 2-Hydroxy-4-(beta-hydroxyethyl)aminotoluene, 2-Methyl-5-(N-beta-hydroxyethylamino)phenol, Phenol, 5-((2-hydroxyethyl)amino)-2-methyl-, LS-104691, 1-Methyl-2-hydroxy-4-(beta-hydroxyethyl)aminobenzene

Molecular Formula:	C₉H₁₃NO₂	Molecular Weight:	167.205020 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: YGRFRBUGAPOJDU-UHFFFAOYSA-N

• (1S)-(-)-3-Bromocamphor-8-sulfonic acid ammonium salt

IUPAC Name: azanium (3-bromo-1,7-dimethyl-2-oxo-7-bicyclo[2.2.1]heptanyl)methanesulfonate | CAS Registry Number: 55870-50-3
Synonyms: EINECS 238-616-9, EINECS 259-871-2, ST5411882, Ammonium D-5-bromo-6-oxo-9-bornanesulphonate, Ammonium L-5-bromo-6-oxo-9-bornanesulphonate, 14575-84-9

Molecular Formula:	C₁₀H₁₈BrNO₄S	Molecular Weight:	328.223220 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: GFBVBBRNPGPROZ-UHFFFAOYSA-N

• 2-Chloromethylbenzimidazole

IUPAC Name: 2-(chloromethyl)-1H-benzimidazole | CAS Registry Number: 4857-04-9
Synonyms: Dimezole-7, 2-(Chloromethyl)benzimidazole, Bionet2_000972, NCIOpen2_001638, C52055_ALDRICH, 2-(Chloromethyl)-1H-benzimidazole, TOS-BB-1230, WLN: T56 BM DNJ C1G, ZERO/001716, Benzimidazole, 2-(chloromethyl)-, 1H-Benzimidazole, 2-(chloromethyl)-, ALBB-003825, NSC15436, PDC 6886, EINECS 225-452-8, NSC103708, ZINC00088441, InChI=1/C8H7ClN2/c9-5-8-10-6-3-1-2-4-7(6)11-8/h1-4H,5H2,(H,10,11

Molecular Formula:	C₈H₇ClN₂	Molecular Weight:	166.607580 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: SPMLMLQATWNZEE-UHFFFAOYSA-N

• 2-Phenylacrylic acid

IUPAC Name: 2-phenylprop-2-enoic acid | CAS Registry Number: 492-38-6
Synonyms: Atropic acid, .alpha.-Phenyl acrylic acid, Acrylic acid, 2-phenyl-, alpha-Phenyl acrylic acid, 2-Propenoic acid, 2-phenyl-, NSC20987, Benzeneacetic acid, .alpha.-methylene-, CID68114, alpha-Toluic acid, alpha-methylene-, EINECS 207-753-6, NSC 20987, .alpha.-Toluic acid, .alpha.-methylene-, Benzeneacetic acid, alpha-methylene- (9CI)

Molecular Formula:	C₉H₈O₂	Molecular Weight:	148.158620 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: ONPJWQSDZCGSQM-UHFFFAOYSA-N

• 2-Fluorocinnamic acid

IUPAC Name: (E)-3-(2-fluorophenyl)prop-2-enoic acid | CAS Registry Number: 451-69-4
Synonyms: o-Fluorocinnamic acid, Cinnamic acid, o-fluoro-, ortho-Fluorocinnamate, 2-Propenoic acid, 3-(2-fluorophenyl)-, 222712_ALDRICH, EINECS 207-195-3, Cinnamic acid, o-fluoro-, (Z)-, NSC73989, BRN 1863963, IVK/1011865, LS-54106, TL8003132, (2E)-3-(2-Fluorophenyl)-2-propenoic acid, 2-Propenoic acid, 3-(2-fluorophenyl)-, (E)-, 0-09-00-00594 (Beilstein Handbook Reference), 20595-29-3

Molecular Formula:	C₉H₇FO₂	Molecular Weight:	166.149083 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: IOUDZAFBPDDAMK-AATRIKPKSA-N

• 3-Fluorocinnamic acid

IUPAC Name: (E)-3-(3-fluorophenyl)prop-2-enoic acid | CAS Registry Number: 458-46-8
Synonyms: m-Fluorocinnamic acid, (E)-m-Fluorocinnamic acid, trans-3-Fluorocinnamic acid, 290483_ALDRICH, JRD-0525, NSC73988, EINECS 207-281-0, EINECS 243-902-1, SBB006621, trans-3-(3-Fluorophenyl)propenoic acid, TL8003182, (2E)-3-(3-Fluorophenyl)-2-propenoic acid, 2-Propenoic acid, 3-(3-fluorophenyl)-, (E)-, 20595-30-6

Molecular Formula:	C₉H₇FO₂	Molecular Weight:	166.149083 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: RTSIUKMGSDOSTI-SNAWJCMRSA-N

• 4-Aminodiphenylamine sulfate

IUPAC Name: 1-N-phenylbenzene-1,4-diamine; sulfuric acid | CAS Registry Number: 4698-29-7
Synonyms: p-Aminodiphenylamine sulfate, N-Phenyl-p-phenylenediamine sulfate, EINECS 225-173-1, N-Phenyl-1,4-benzenediamine sulfate, Bis(N-phenylbenzene-p-diamine) sulphate, N-Phenyl-p-phenylenediamine, hemisulfate, 1,4-Benzenediamine, N-phenyl-, sulfate (2:1), 101-54-2

Molecular Formula:	C₂₄H₂₆N₄O₄S	Molecular Weight:	466.552640 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	8

InChIKey: ZRFXOEFNFAPWJA-UHFFFAOYSA-N

• 2-(2,4-Diamino)benzyloxyethanol dihydrochloride

IUPAC Name: 2-(2,4-diaminophenoxy)ethanol | CAS Registry Number: 66422-95-5
Synonyms: 2,4-Diaminophenoxyethanol, 2-(2',4'-Diaminophenoxy)ethanol, EINECS 274-713-2, Ethanol, 2-(2,4-diaminophenoxy)-, (4-(2-Hydroxyethoxy)-1,3-phenylene)diammonium sulphate, 70643-19-5, 70643-20-8

Molecular Formula:	C₈H₁₂N₂O₂	Molecular Weight:	168.193080 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: WCPGNFONICRLCL-UHFFFAOYSA-N

• 5-Methoxytryptamine hydrochloride

IUPAC Name: 2-(5-methoxy-1H-indol-3-yl)ethylazanium | CAS Registry Number: 66-83-1
Synonyms: ZINC00057163, CID3639669

Molecular Formula:	C₁₁H₁₅N₂O+	Molecular Weight:	191.249600 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: JTEJPPKMYBDEMY-UHFFFAOYSA-O

• 2-Aminophenol hemisulfate salt

IUPAC Name: 2-aminophenol sulfate | CAS Registry Number: 67845-79-8
Synonyms: o-Aminophenol, hemisulfate, EINECS 267-335-4, Bis((2-hydroxyphenyl)ammonium) sulphate, Phenol, 2-amino-, sulfate (2:1) (salt)

Molecular Formula:	C₁₂H₁₄N₂O₆S-₂	Molecular Weight:	314.314360 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	8

InChIKey: SHUIDGXTJAQFJO-UHFFFAOYSA-L

• 2,4-Diamino phenetole sulfate

IUPAC Name: 4-ethoxybenzene-1,3-diamine; sulfuric acid | CAS Registry Number: 68015-98-5
Synonyms: HSDB 6239, 4-Ethoxy-m-phenylenediamine sulfate, CID50020, EINECS 268-164-8, m-Phenylenediamine, 4-ethoxy-, sulfate, 4-Ethoxybenzene-1,3-diammonium sulphate, 1,3-Benzenediamine, 4-ethoxy-, sulfate, 4-ETHOXY-1,3-BENZENEDIAMINE SULFATE, 1,3-Benzenediamine, 4-ethoxy-, sulfate (1:1), 5862-77-1, 6219-69-8

Molecular Formula:	C₈H₁₄N₂O₅S	Molecular Weight:	250.272160 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	7

InChIKey: WRYXZLYZWDZVKS-UHFFFAOYSA-N

• 7-Hydroxy-1H-quinolin-2-one

IUPAC Name: 7-hydroxy-1H-quinolin-2-one | CAS Registry Number: 70500-72-0
Synonyms: 7-hydroxy-1H-quinolin-2-one, 2,7-Dihydroxyquinoline, 7-Hydroxycarbostyril, 7-Hydroxyquinolinone, 7-hydroxyquinolin-2(1H)-one, quinoline-2,7-diol, AG-G-75261, PubChem5866, 7-hydroxy-2-quinolone, SureCN252706, SureCN5958458, 7-hydroxyhydroquinolin-2-one, 7-Hydroxy-2(1H)-quinolinone, 7-oxidanyl-1H-quinolin-2-one, QUI074, CHEBI:48987, CTK3J5947, MolPort-003-848-051, MolPort-008-426-778, ACT01971

Molecular Formula:	C₉H₇NO₂	Molecular Weight:	161.157380 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: DBSPUDKBNOZFMX-UHFFFAOYSA-N

• 2,4-Diaminophenoxyethanol sulfate

IUPAC Name: 2-(2,4-diaminophenoxy)ethanol | CAS Registry Number: 70643-20-8
Synonyms: 2,4-Diaminophenoxyethanol, 2-(2',4'-Diaminophenoxy)ethanol, EINECS 274-713-2, Ethanol, 2-(2,4-diaminophenoxy)-, (4-(2-Hydroxyethoxy)-1,3-phenylene)diammonium sulphate, 66422-95-5, 70643-19-5

Molecular Formula:	C₈H₁₂N₂O₂	Molecular Weight:	168.193080 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: WCPGNFONICRLCL-UHFFFAOYSA-N

• 5-bromo-2-mercapto benzothlazole

IUPAC Name: 5-bromo-3H-1,3-benzothiazole-2-thione | CAS Registry Number: 71216-20-1
Synonyms: 5-Bromo-2-mercaptobenzothiazole, SureCN1850412, ACMC-1BC48, 5-bromobenzothiazole-2-thiol, AC1N9C13, 5-bromobenzo[d]thiazole-2-thiol, CTK5I8241, 5-Bromo-2-mercaptobenzothiazole,, MolPort-002-892-922, ANW-36009, SBB100094, AKOS015834695, AKOS015904175, AG-A-84193, 5-bromo-3H-1,3-benzothiazole-2-thione, AK-24346, K204, KB-42098, 5-BROMO-2-MERCAPTO BENZO THIAZOLE, KB-245306

Molecular Formula:	C₇H₄BrNS₂	Molecular Weight:	246.147360 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: OKHQGCOLOHTELL-UHFFFAOYSA-N

• 4-Bromophenethylamine

IUPAC Name: 2-(4-bromophenyl)ethanamine | CAS Registry Number: 73918-56-6
Synonyms: p-Bromophenethylamine, Benzeneethanamine, 4-bromo-, 189308_ALDRICH, EINECS 277-636-2, CID533915, FS000610, ST5406674

Molecular Formula:	C₈H₁₀BrN	Molecular Weight:	200.075700 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: ZSZCXAOQVBEPME-UHFFFAOYSA-N

• 1,3-Bis(2,4-diaminophenoxy)propane hydrochloride

IUPAC Name: 4-[3-(2,4-diaminophenoxy)propoxy]benzene-1,3-diamine;tetrahydrochloride | CAS Registry Number: 74918-21-1
Synonyms: 1,3-BIS(2,4-DIAMINOPHENOXY)PROPANE TETRAHYDROCHLORIDE, 1,3-Bis(2,4-diaminophenoxy)propane 4HCl, 4,4'-(Propane-1,3-diylbis(oxy))bis(benzene-1,3-diamine) tetrahydrochloride, SureCN1426505, KSC377C6P, CTK2H7167, MolPort-006-138-443, EINECS 278-022-7, ANW-73006, AKOS015895592, AG-G-98200, AK109178, I717, FT-0657692, ST51052907, A838262, 4,4'-(Propane-1,3-diylbis(oxy))bisbenzene-1,3-diamine tetrahydrochloride, 4-[3-(2,4-diaminophenoxy)propoxy]benzene-1,3-diamine tetrahydrochloride, 1,3-Benzenediamine,4,4'-[1,3-propanediylbis(oxy)]bis-, tetrahydrochloride (9CI);, 4-[3-[2,4-bis(azanyl)phenoxy]propoxy]benzene-1,3-diamine tetrahydrochloride

Molecular Formula:	C₁₅H₂₄Cl₄N₄O₂	Molecular Weight:	434.188660 [g/mol]
H-Bond Donor:	8	H-Bond Acceptor:	6

InChIKey: UXPUOLAAWYPPLE-UHFFFAOYSA-N

• 3-ethyl-4-methyl-3-pyrroline-2-one

IUPAC Name: 4-ethyl-3-methyl-1,2-dihydropyrrol-5-one | CAS Registry Number: 766-36-9
Synonyms: 556815_ALDRICH, ZINC00404205, 3-Ethyl-4-methyl-3-pyrrolin-2-one, InChI=1/C7H11NO/c1-3-6-5(2)4-8-7(6)9/h3-4H2,1-2H3,(H,8,9

Molecular Formula:	C₇H₁₁NO	Molecular Weight:	125.168340 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: YCTNTSVMJWIYTQ-UHFFFAOYSA-N

• 3-Methylquinoline

IUPAC Name: 3-methylquinoline | CAS Registry Number: 612-58-8
Synonyms: 3-METHYLQUINOLINE, Quinoline, 3-methyl-, beta-Methylquinoline, 3-Methyl-1-benzazine, CCRIS 2896, 382493_ALDRICH, NSC 109149, CHEBI:20140, EINECS 210-315-7, CPD-962, BRN 0110325, c0070, NSC109149, ZINC01701249, Quinoline, 3-methyl- (7CI,8CI,9CI), LS-142038, 5-20-07-00388 (Beilstein Handbook Reference), C081194, InChI=1/C10H9N/c1-8-6-9-4-2-3-5-10(9)11-7-8/h2-7H,1H

Molecular Formula:	C₁₀H₉N	Molecular Weight:	143.185160 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: DTBDAFLSBDGPEA-UHFFFAOYSA-N

• 2,5-Diamino Toluene Sulfate

IUPAC Name: 2-methylbenzene-1,4-diamine; sulfuric acid | CAS Registry Number: 615-50-9
Synonyms: Fouramine STD, 2,5-Diaminotoluene sulfate, 2,5-Toluenediamine sulfate, oxidation base 14, CI Oxidation Base 4, C.I. Oxidation Base 4, ox idation base 14, p-Tolylenediamine sulfate, para-Toluenediamine sulphate, Toluene-2,5-diamine, sulfate, P-TOLUENEDIAMINE SULFATE, p-Toluylenediamine sulfate, para-Toluylenediamine sulphate, Toluene-2,5-diamine sulfate, CCRIS 595, para-Toluenediamine sulfate, Toluene-2,5-diamine sulphate, Toluylene-2,5-diamine sulfate, NCI-C01832, Toluylene-2,5-diamine sulphate

Molecular Formula:	C₇H₁₂N₂O₄S	Molecular Weight:	220.246180 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: KZTWOUOZKZQDMN-UHFFFAOYSA-N

• 4-Nitrocinnamic acid

IUPAC Name: (E)-3-(4-nitrophenyl)prop-2-enoate | CAS Registry Number: 619-89-6
Synonyms: ZINC00164538

Molecular Formula:	C₉H₆NO₄-	Molecular Weight:	192.148240 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: XMMRNCHTDONGRJ-ZZXKWVIFSA-M

• 2-chloro-1,4-benzenediamine sulfate

IUPAC Name: 2-chlorobenzene-1,4-diamine; sulfuric acid | CAS Registry Number: 6219-71-2
Synonyms: Fourrine SO, renal brown so, Renal SO, Fourrine 81, 2-Cl-p-PD, C.I. Oxidation Base 13A, CCRIS 145, 2-Chloro-p-phenylenediamine sulfate, 3-Chloro-4-aminoaniline sulfate, HSDB 6247, NCI-C03316, 2-Chloro-p-phenylenediamine SO4, 24240_FLUKA, EINECS 228-291-1, EINECS 262-915-3, 2-Chloro p-phenylenediamine sulphate, 2-chlorobenzene-1,4-diamine sulfate, 2-Chloro-1,4-phenylenediamine sulfate, CID22584, p-Phenylenediamine, 2-chloro-, sulfate

Molecular Formula:	C₆H₉ClN₂O₄S	Molecular Weight:	240.664660 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: GQFGHCRXPLROOF-UHFFFAOYSA-N