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HLW

HLW
Name:	3-(3-chlorophenyl)-N-{2-[2-(1H-imidazol-1-yl)pyrimidin-4-yl]ethyl}propan-1-amine
Formula:	C18 H20 Cl N5
SMILES:	Clc1cccc(c1)CCCNCCc2nc(ncc2)n3ccnc3
InChi:	InChI=1S/C18H20ClN5/c19-16-5-1-3-15(13-16)4-2-8-20-9-6-17-7-10-22-18(23-17)24-12-11-21-14-24/h1,3,5,7,10-14,20H,2,4,6,8-9H2
Synonyms:	N-2-(2-(1H-IMIDAZOL-1-YL)PYRIMIDIN-4-YL)ETHYL-3-(3-CHLOROPHENYL)PROPAN-1-AMINE
Definition date:	2014-10-21
Last modified:	2021-03-01
Release date:	2014-12-24
Identifier:	3-(3-chlorophenyl)-N-{2-[2-(1H-imidazol-1-yl)pyrimidin-4-yl]ethyl}propan-1-amine

HM6

HM6
Name:	4-(4-(hydroxymethyl)-1h-1,2,3-triazol-1-yl)pyridine-2,6-dicarboxylic acid
Formula:	C10 H8 N4 O5
SMILES:	O=C(O)c1nc(cc(c1)n2nnc(c2)CO)C(=O)O
InChi:	InChI=1S/C10H8N4O5/c15-4-5-3-14(13-12-5)6-1-7(9(16)17)11-8(2-6)10(18)19/h1-3,15H,4H2,(H,16,17)(H,18,19)
Synonyms:	HYDROXYMETHYLTRIAZOLE DIPICOLINIC ACID
Definition date:	2012-09-13
Last modified:	2021-03-01
Release date:	2012-11-09
Identifier:	4-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]pyridine-2,6-dicarboxylic acid

HMD

HMD
Name:	4-(5-AMINO-4-OXO-4H-PYRAZOL-3-YL)-2-BROMO-4,5,6,7-TETRAHYDRO-3AH-PYRROLO[2,3-C]AZEPIN-8-ONE
Formula:	C11 H10 Br N5 O2
SMILES:	O=C1N=C(N=C1C3CCNC(=O)C2=NC(Br)=CC23)N
InChi:	InChI=1S/C11H10BrN5O2/c12-6-3-5-4(7-10(19)17-11(13)16-7)1-2-14-9(18)8(5)15-6/h3-5H,1-2H2,(H,14,18)(H2,13,17,19)/t4-,5-/m0/s1
Synonyms:	HYMENIALDISINE
Definition date:	1999-12-16
Last modified:	2021-03-01
Identifier:	(3aR,4S)-4-(2-amino-4-oxo-4H-imidazol-5-yl)-2-bromo-4,5,6,7-tetrahydropyrrolo[2,3-c]azepin-8(3aH)-one

HNF

HNF
Name:	7-nitro-9H-fluoren-2-ol
Formula:	C13 H9 N O3
SMILES:	Oc1ccc2c(Cc3cc(ccc23)[N+]([O-])=O)c1
InChi:	InChI=1S/C13H9NO3/c15-11-2-4-13-9(7-11)5-8-6-10(14(16)17)1-3-12(8)13/h1-4,6-7,15H,5H2
Synonyms:	2-hydroxy-7-nitrofluorene
Definition date:	2009-03-27
Last modified:	2021-03-01
Identifier:	7-nitro-9H-fluoren-2-ol

6JR

6JR
Name:	3-[(2S,4aR,6R,7R,7aS)-2,7-dihydroxy-2-oxotetrahydro-2H,4H-2lambda~5~-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-6-phenyl-3,4-dihydro-9H-imidazo[1,2-a]purin-9-one
Formula:	C18 H16 N5 O7 P
SMILES:	n54C(c3ncn(C2OC1COP(OC1C2O)(O)=O)c3Nc4nc(c5)c6ccccc6)=O
InChi:	InChI=1S/C18H16N5O7P/c24-13-14-11(7-28-31(26,27)30-14)29-17(13)23-8-19-12-15(23)21-18-20-10(6-22(18)16(12)25)9-4-2-1-3-5-9/h1-6,8,11,13-14,17,24H,7H2,(H,20,21)(H,26,27)/t11-,13-,14-,17-/m1/s1
Synonyms:	PET-cGMP
Definition date:	2016-04-19
Last modified:	2021-03-01
Release date:	2017-08-09
Identifier:	3-[(2S,4aR,6R,7R,7aS)-2,7-dihydroxy-2-oxotetrahydro-2H,4H-2lambda~5~-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-6-phenyl-3,4-dihydro-9H-imidazo[1,2-a]purin-9-one

HNJ

HNJ
Name:	3-{[2-(pyrrolidin-1-yl)phenyl]amino}-1H-1lambda~6~,2-benzothiazole-1,1-dione
Formula:	C17 H17 N3 O2 S
SMILES:	C1CN(CC1)c2c(cccc2)NC=4c3c(cccc3)S(=O)(=O)N=4
InChi:	InChI=1S/C17H17N3O2S/c21-23(22)16-10-4-1-7-13(16)17(19-23)18-14-8-2-3-9-15(14)20-11-5-6-12-20/h1-4,7-10H,5-6,11-12H2,(H,18,19)
Synonyms:	(3-Chloro-Phenyl)-acetic acid (S)-1-(2-tert-butoxycarbonylamino-acetyl)-pyrrolidin-2-ylmethyl ester
Definition date:	2018-07-16
Last modified:	2021-03-01
Release date:	2019-02-13
Identifier:	3-{[2-(pyrrolidin-1-yl)phenyl]amino}-1H-1lambda~6~,2-benzothiazole-1,1-dione

HNK

HNK
Name:	5-[(2R)-1-methylpyrrolidin-2-yl]pyridin-2-ol
Formula:	C10 H14 N2 O
SMILES:	n1cc(ccc1O)C2N(C)CCC2
InChi:	InChI=1S/C10H14N2O/c1-12-6-2-3-9(12)8-4-5-10(13)11-7-8/h4-5,7,9H,2-3,6H2,1H3,(H,11,13)/t9-/m1/s1
Synonyms:	6-hydroxy-D-nicotine
Definition date:	2010-06-17
Last modified:	2021-03-01
Identifier:	5-[(2R)-1-methylpyrrolidin-2-yl]pyridin-2-ol

HNL

HNL
Name:	5-[(2S)-1-methylpyrrolidin-2-yl]pyridin-2-ol
Formula:	C10 H14 N2 O
SMILES:	n1cc(ccc1O)C2N(C)CCC2
InChi:	InChI=1S/C10H14N2O/c1-12-6-2-3-9(12)8-4-5-10(13)11-7-8/h4-5,7,9H,2-3,6H2,1H3,(H,11,13)/t9-/m0/s1
Synonyms:	6-hydroxy-L-nicotine
Definition date:	2009-10-14
Last modified:	2021-03-01
Identifier:	5-[(2S)-1-methylpyrrolidin-2-yl]pyridin-2-ol

HOE

HOE
Name:	2'-(4-HYDROXYPHENYL)-5-(4-METHYL-1-PIPERAZINYL)-2,5'-BI-BENZIMIDAZOLE
Formula:	C25 H25 N6 O
SMILES:	Oc1ccc(cc1)c3nc2ccc(cc2n3)c6nc4c(cc(cc4)N5CC[NH+](CC5)C)n6
InChi:	InChI=1S/C25H24N6O/c1-30-10-12-31(13-11-30)18-5-9-21-23(15-18)29-25(27-21)17-4-8-20-22(14-17)28-24(26-20)16-2-6-19(32)7-3-16/h2-9,14-15,32H,10-13H2,1H3,(H,26,28)(H,27,29)/p+1
Synonyms:	HOECHST 33258
Definition date:	1999-07-08
Last modified:	2021-03-01
Identifier:	4-[2'-(4-hydroxyphenyl)-1H,3'H-2,5'-bibenzimidazol-6-yl]-1-methylpiperazin-1-ium

HOP

HOP
Name:	(1S,2S,5S)2-(4-GLUTARIDYLBENZYL)-5-PHENYL-1-CYCLOHEXANOL
Formula:	C23 H27 N O4
SMILES:	O=C(O)CCCNC(=O)c1ccc(cc1)C3CCC(c2ccccc2)CC3O
InChi:	InChI=1S/C23H27NO4/c25-21-15-19(16-5-2-1-3-6-16)12-13-20(21)17-8-10-18(11-9-17)23(28)24-14-4-7-22(26)27/h1-3,5-6,8-11,19-21,25H,4,7,12-15H2,(H,24,28)(H,26,27)/t19-,20+,21-/m0/s1
Synonyms:	OXY-COPE-HAPTEN
Definition date:	1999-07-08
Last modified:	2021-03-01
Identifier:	4-[({4-[(1R,2S,4S)-2-hydroxy-4-phenylcyclohexyl]phenyl}carbonyl)amino]butanoic acid

HP1

HP1
Name:	~{N}-[5-[[5-[[5-[[3-[3-(dimethylamino)propylamino]-3-oxidanylidene-propyl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-4-oxidanyl-pyrrol-3-yl]-1-methyl-imidazole-2-carboxamide
Formula:	C31 H41 N11 O6
SMILES:	CN(C)CCCNC(=O)CCNC(=O)c1cc(NC(=O)c2cc(NC(=O)c3n(C)cc(NC(=O)c4nccn4C)c3O)cn2C)cn1C
InChi:	InChI=1S/C31H41N11O6/c1-38(2)12-7-9-32-24(43)8-10-34-28(45)22-14-19(16-40(22)4)35-29(46)23-15-20(17-41(23)5)36-30(47)25-26(44)21(18-42(25)6)37-31(48)27-33-11-13-39(27)3/h11,13-18,44H,7-10,12H2,1-6H3,(H,32,43)(H,34,45)(H,35,46)(H,36,47)(H,37,48)
Synonyms:	IMIDAZOLE-HYDROXYPYRROLE-PYRROLE-PYRROLE-BETA ALANINE-DIMETHYLAMINO PROPYLAMIDE
Definition date:	1999-07-08
Last modified:	2021-03-01
Identifier:	~{N}-[5-[[5-[[5-[[3-[3-(dimethylamino)propylamino]-3-oxidanylidene-propyl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-4-oxidanyl-pyrrol-3-yl]-1-methyl-imidazole-2-carboxamide

HP2

HP2
Name:	HYDROXYPYRROLE-IMIDAZOLE-PYRROLE POLYAMIDE
Formula:	C31 H41 N11 O6
SMILES:	O=C(Nc3cc(C(=O)Nc2c(O)c(C(=O)Nc1cc(C(=O)NCCC(=O)NCCCN(C)C)n(c1)C)n(c2)C)n(c3)C)c4nccn4C
InChi:	InChI=1S/C31H41N11O6/c1-38(2)12-7-9-32-24(43)8-10-34-28(45)22-14-19(16-40(22)4)35-30(47)25-26(44)21(18-42(25)6)37-29(46)23-15-20(17-41(23)5)36-31(48)27-33-11-13-39(27)3/h11,13-18,44H,7-10,12H2,1-6H3,(H,32,43)(H,34,45)(H,35,47)(H,36,48)(H,37,46)
Synonyms:	IMIDAZOLE-PYRROLE-HYDROXYPYRROLE-PYRROLE-BETA ALANINE-DIMETHYLAMINO PROPYLAMIDE
Definition date:	2000-07-25
Last modified:	2021-03-01
Identifier:	N-(5-{[5-({5-[(3-{[3-(dimethylamino)propyl]amino}-3-oxopropyl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-4-hydroxy-1-methyl-1H-pyrrol-3-yl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)-1-methyl-1H-imidazole-2-carboxamide

6LD

6LD
Name:	Sacubitrilat
Formula:	C22 H25 N O5
SMILES:	c1(ccc(CC(NC(CCC(=O)O)=O)CC(C)C(O)=O)cc1)c2ccccc2
InChi:	InChI=1S/C22H25NO5/c1-15(22(27)28)13-19(23-20(24)11-12-21(25)26)14-16-7-9-18(10-8-16)17-5-3-2-4-6-17/h2-10,15,19H,11-14H2,1H3,(H,23,24)(H,25,26)(H,27,28)/t15-,19+/m1/s1
Synonyms:	LBQ657
Definition date:	2016-04-29
Last modified:	2021-03-01
Release date:	2016-06-15
Identifier:	(2R,4S)-5-([1,1'-biphenyl]-4-yl)-4-[(3-carboxypropanoyl)amino]-2-methylpentanoic acid

HPS

HPS
Name:	PHENYL DIHYDROGEN PHOSPHATE
Formula:	C6 H7 O4 P
SMILES:	O=P(Oc1ccccc1)(O)O
InChi:	InChI=1S/C6H7O4P/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5H,(H2,7,8,9)
Synonyms:	PHENYLPHOSPHATE
Definition date:	2003-06-20
Last modified:	2021-03-01
Identifier:	phenyl dihydrogen phosphate

HQO

HQO
Name:	2-HEPTYL-4-HYDROXY QUINOLINE N-OXIDE
Formula:	C16 H21 N O2
SMILES:	[O-][n+]2c1ccccc1c(O)cc2CCCCCCC
InChi:	InChI=1S/C16H21NO2/c1-2-3-4-5-6-9-13-12-16(18)14-10-7-8-11-15(14)17(13)19/h7-8,10-12,18H,2-6,9H2,1H3
Synonyms:	2-HEPTYL-1-OXY-QUINOLIN-4-OL
Definition date:	2001-11-28
Last modified:	2021-03-01
Identifier:	2-heptylquinolin-4-ol 1-oxide

HRO

HRO
Name:	5-chloro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid
Formula:	C5 H3 Cl N2 O4
SMILES:	O=C1NC(C(=O)O)=C(Cl)C(=O)N1
InChi:	InChI=1S/C5H3ClN2O4/c6-1-2(4(10)11)7-5(12)8-3(1)9/h(H,10,11)(H2,7,8,9,12)
Synonyms:	5-Chloroorotic acid
Definition date:	2012-11-19
Last modified:	2021-03-01
Release date:	2013-11-20
Identifier:	5-chloro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid

HS3

HS3
Name:	(2R)-3-hydroxy-2-[(4-methoxyphenyl)sulfonylamino]-N-oxo-propanamide
Formula:	C10 H12 N2 O6 S
SMILES:	O=NC(=O)C(NS(=O)(=O)c1ccc(OC)cc1)CO
InChi:	InChI=1S/C10H12N2O6S/c1-18-7-2-4-8(5-3-7)19(16,17)12-9(6-13)10(14)11-15/h2-5,9,12-13H,6H2,1H3/t9-/m1/s1
Synonyms:	(R)-N-(3-hydroxy-1-nitroso-1-oxopropan-2-yl)-4-methoxybenzenesulfonamide
Definition date:	2008-11-04
Last modified:	2021-03-01
Identifier:	N~2~-[(4-methoxyphenyl)sulfonyl]-N-oxo-D-serinamide

HS5

HS5
Name:	2-[(4-fluorophenyl)sulfonyl-(2-hydroxyethyl)amino]-N-oxo-ethanamide
Formula:	C10 H11 F N2 O5 S
SMILES:	O=S(=O)(c1ccc(F)cc1)N(CC(=O)N=O)CCO
InChi:	InChI=1S/C10H11FN2O5S/c11-8-1-3-9(4-2-8)19(17,18)13(5-6-14)7-10(15)12-16/h1-4,14H,5-7H2
Synonyms:	4-fluoro-N-(2-hydroxyethyl)-N-(2-nitroso-2-oxoethyl)benzenesulfonamide
Definition date:	2008-11-04
Last modified:	2021-03-01
Identifier:	N~2~-[(4-fluorophenyl)sulfonyl]-N~2~-(2-hydroxyethyl)-N-oxoglycinamide

6OJ

6OJ
Name:	7,8-bis(chloranyl)-9-methyl-3,4-dihydro-2H-pyrido[3,4-b]indol-1-one
Formula:	C12 H10 Cl2 N2 O
SMILES:	Clc1ccc2c(c1Cl)n(c3c2CCNC3=O)C
InChi:	InChI=1S/C12H10Cl2N2O/c1-16-10-6(2-3-8(13)9(10)14)7-4-5-15-12(17)11(7)16/h2-3H,4-5H2,1H3,(H,15,17)
Synonyms:	Dihydro-Bauerine C
Definition date:	2012-05-03
Last modified:	2021-03-01
Identifier:	7,8-dichloro-9-methyl-2,3,4,9-tetrahydro-1H-beta-carbolin-1-one

HSI

HSI
Name:	(3R)-3-{4-[(4-CHLOROPHENYL)ETHYNYL]BENZOYL}NONANOIC ACID
Formula:	C24 H25 Cl O3
SMILES:	Clc2ccc(C#Cc1ccc(C(=O)C(CC(=O)O)CCCCCC)cc1)cc2
InChi:	InChI=1S/C24H25ClO3/c1-2-3-4-5-6-21(17-23(26)27)24(28)20-13-9-18(10-14-20)7-8-19-11-15-22(25)16-12-19/h9-16,21H,2-6,17H2,1H3,(H,26,27)/t21-/m1/s1
Synonyms:	(4-(4-(2-(4-CHLOROPHENYL)ETHYNYL)PHENYL))-3-HEXYL-4-OXOBUTANOIC ACID
Definition date:	2007-05-23
Last modified:	2021-03-01
Identifier:	(3R)-3-({4-[(4-chlorophenyl)ethynyl]phenyl}carbonyl)nonanoic acid

HT1

HT1
Name:	2'-(4-ETHOXYPHENYL)-5-(4-METHYL-1-PIPERAZINYL)-2,5'-BI-BENZIMIDAZOLE
Formula:	C27 H28 N6 O
SMILES:	O(c1ccc(cc1)c3nc2ccc(cc2n3)c5nc4ccc(cc4n5)N6CCN(C)CC6)CC
InChi:	InChI=1S/C27H28N6O/c1-3-34-21-8-4-18(5-9-21)26-28-22-10-6-19(16-24(22)30-26)27-29-23-11-7-20(17-25(23)31-27)33-14-12-32(2)13-15-33/h4-11,16-17H,3,12-15H2,1-2H3,(H,28,30)(H,29,31)
Synonyms:	HOECHST 33342
Definition date:	1999-07-08
Last modified:	2021-03-01
Identifier:	2'-(4-ethoxyphenyl)-6-(4-methylpiperazin-1-yl)-1H,3'H-2,5'-bibenzimidazole

6PH

6PH
Name:	(1R)-2-(phosphonooxy)-1-[(tridecanoyloxy)methyl]ethyl pentadecanoate
Formula:	C31 H61 O8 P
SMILES:	O=P(O)(OCC(OC(=O)CCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCC)O
InChi:	InChI=1S/C31H61O8P/c1-3-5-7-9-11-13-15-16-18-20-22-24-26-31(33)39-29(28-38-40(34,35)36)27-37-30(32)25-23-21-19-17-14-12-10-8-6-4-2/h29H,3-28H2,1-2H3,(H2,34,35,36)/t29-/m1/s1
Synonyms:	PHOSPHATIDIC ACID
Definition date:	2008-04-30
Last modified:	2021-03-01
Identifier:	(1R)-2-(phosphonooxy)-1-[(tridecanoyloxy)methyl]ethyl pentadecanoate

HT6

HT6
Name:	(3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-[(hexylsulfanyl)methyl]pyrrolidin-3-ol
Formula:	C18 H29 N5 O S
SMILES:	OC1C(CSCCCCCC)CN(C1)Cc2cnc3c2ncnc3N
InChi:	InChI=1S/C18H29N5OS/c1-2-3-4-5-6-25-11-14-9-23(10-15(14)24)8-13-7-20-17-16(13)21-12-22-18(17)19/h7,12,14-15,20,24H,2-6,8-11H2,1H3,(H2,19,21,22)/t14-,15+/m1/s1
Synonyms:	Hexylthio-DADMe-Immucillin-A
Definition date:	2017-09-11
Last modified:	2021-03-01
Release date:	2018-09-12
Identifier:	(3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-[(hexylsulfanyl)methyl]pyrrolidin-3-ol

HTQ

HTQ
Name:	HOMOTROPINE
Formula:	C16 H21 N O3
SMILES:	O=C(OC2CC1N(C)C(CC1)C2)C(O)c3ccccc3
InChi:	InChI=1S/C16H21NO3/c1-17-12-7-8-13(17)10-14(9-12)20-16(19)15(18)11-5-3-2-4-6-11/h2-6,12-15,18H,7-10H2,1H3/t12-,13+,14-,15-/m1/s1
Synonyms:	HYDROXY-PHENYL-ACETIC ACID 8-METHYL-8-AZA-BICYCLO[3.2.1]OCT-3-YL ESTER
Definition date:	2002-10-24
Last modified:	2021-03-01
Identifier:	(3-exo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl (2R)-hydroxy(phenyl)ethanoate

HTX

HTX
Name:	heptan-2-one
Formula:	C7 H14 O
SMILES:	CCCCCC(C)=O
InChi:	InChI=1S/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3
Synonyms:	2-heptanone
Definition date:	2009-11-05
Last modified:	2021-03-01
Identifier:	heptan-2-one

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