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OMY

OMY
Name:	(betaR)-3-chloro-beta-hydroxy-L-tyrosine
Formula:	C9 H10 Cl N O4
SMILES:	Clc1cc(ccc1O)C(O)C(C(=O)O)N
InChi:	InChI=1S/C9H10ClNO4/c10-5-3-4(1-2-6(5)12)8(13)7(11)9(14)15/h1-3,7-8,12-13H,11H2,(H,14,15)/t7-,8+/m0/s1
Definition date:	2009-03-27
Last modified:	2023-11-03
Identifier:	(betaR)-3-chloro-beta-hydroxy-L-tyrosine

OMZ

OMZ
Name:	(betaR)-3-CHLORO-BETA-HYDROXY-D-TYROSINE
Formula:	C9 H10 Cl N O4
SMILES:	Clc1cc(ccc1O)C(O)C(C(=O)O)N
InChi:	InChI=1S/C9H10ClNO4/c10-5-3-4(1-2-6(5)12)8(13)7(11)9(14)15/h1-3,7-8,12-13H,11H2,(H,14,15)/t7-,8-/m1/s1
Definition date:	2010-08-06
Last modified:	2023-11-03
Identifier:	(betaR)-3-chloro-beta-hydroxy-D-tyrosine

ONU

ONU
Name:	4-[3-(2-methoxyanilino)azetidine-1-carbonyl]quinolin-2(1H)-one
Formula:	C20 H19 N3 O3
SMILES:	O=C(C1=CC(=O)Nc2ccccc21)N1CC(Nc2ccccc2OC)C1
InChi:	InChI=1S/C20H19N3O3/c1-26-18-9-5-4-8-17(18)21-13-11-23(12-13)20(25)15-10-19(24)22-16-7-3-2-6-14(15)16/h2-10,13,21H,11-12H2,1H3,(H,22,24)
Definition date:	2023-08-17
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	4-[3-(2-methoxyanilino)azetidine-1-carbonyl]quinolin-2(1H)-one

OO1

OO1
Name:	(4-methylphenyl)carbamic acid
Formula:	C8 H9 N O2
SMILES:	C(O)(=O)Nc1ccc(cc1)C
InChi:	InChI=1S/C8H9NO2/c1-6-2-4-7(5-3-6)9-8(10)11/h2-5,9H,1H3,(H,10,11)
Definition date:	2019-07-01
Last modified:	2023-11-03
Release date:	2019-11-06
Identifier:	(4-methylphenyl)carbamic acid

OO6

OO6
Name:	(3S,4R)-6-chloro-N-(isoquinolin-4-yl)-3-methyl-3,4-dihydro-2H-1-benzopyran-4-carboxamide
Formula:	C20 H17 Cl N2 O2
SMILES:	Clc1ccc2OCC(C)C(c2c1)C(=O)Nc1cncc2ccccc21
InChi:	InChI=1S/C20H17ClN2O2/c1-12-11-25-18-7-6-14(21)8-16(18)19(12)20(24)23-17-10-22-9-13-4-2-3-5-15(13)17/h2-10,12,19H,11H2,1H3,(H,23,24)/t12-,19-/m1/s1
Definition date:	2023-08-17
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(3S,4R)-6-chloro-N-(isoquinolin-4-yl)-3-methyl-3,4-dihydro-2H-1-benzopyran-4-carboxamide

OOL

OOL
Name:	(E)-1-(4,6-dimethoxypyrimidin-2-yl)methanimine
Formula:	C7 H9 N3 O2
SMILES:	N=Cc1nc(OC)cc(OC)n1
InChi:	InChI=1S/C7H9N3O2/c1-11-6-3-7(12-2)10-5(4-8)9-6/h3-4,8H,1-2H3/b8-4+
Definition date:	2023-08-17
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(E)-1-(4,6-dimethoxypyrimidin-2-yl)methanimine

OPU

OPU
Name:	(4R)-6-chloro-N-[(4S)-7-methyl[1,2,4]triazolo[4,3-a]pyridin-8-yl]-3,4-dihydro-2H-1-benzopyran-4-carboxamide
Formula:	C17 H15 Cl N4 O2
SMILES:	Cc1ccn2cnnc2c1NC(=O)C1CCOc2ccc(Cl)cc21
InChi:	InChI=1S/C17H15ClN4O2/c1-10-4-6-22-9-19-21-16(22)15(10)20-17(23)12-5-7-24-14-3-2-11(18)8-13(12)14/h2-4,6,8-9,12H,5,7H2,1H3,(H,20,23)/t12-/m1/s1
Definition date:	2023-08-17
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(4R)-6-chloro-N-[(4S)-7-methyl[1,2,4]triazolo[4,3-a]pyridin-8-yl]-3,4-dihydro-2H-1-benzopyran-4-carboxamide

OQF

OQF
Name:	2-(1H-benzotriazol-1-yl)-N-[4-(dimethylamino)phenyl]-N-[(1,3-thiazol-4-yl)methyl]acetamide
Formula:	C20 H20 N6 O S
SMILES:	O=C(Cn1nnc2ccccc21)N(Cc1cscn1)c1ccc(cc1)N(C)C
InChi:	InChI=1S/C20H20N6OS/c1-24(2)16-7-9-17(10-8-16)25(11-15-13-28-14-21-15)20(27)12-26-19-6-4-3-5-18(19)22-23-26/h3-10,13-14H,11-12H2,1-2H3
Definition date:	2023-08-17
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(1H-benzotriazol-1-yl)-N-[4-(dimethylamino)phenyl]-N-[(1,3-thiazol-4-yl)methyl]acetamide

OQL

OQL
Name:	(4R)-6-chloro-N-(isoquinolin-4-yl)-1,2,3,4-tetrahydroquinoline-4-carboxamide
Formula:	C19 H16 Cl N3 O
SMILES:	Clc1ccc2NCCC(c2c1)C(=O)Nc1cncc2ccccc21
InChi:	InChI=1S/C19H16ClN3O/c20-13-5-6-17-16(9-13)15(7-8-22-17)19(24)23-18-11-21-10-12-3-1-2-4-14(12)18/h1-6,9-11,15,22H,7-8H2,(H,23,24)/t15-/m1/s1
Definition date:	2023-08-17
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(4R)-6-chloro-N-(isoquinolin-4-yl)-1,2,3,4-tetrahydroquinoline-4-carboxamide

OQX

OQX
Name:	2-(1H-benzotriazol-1-yl)-N-[(3-chlorophenyl)methyl]-N-(4-methoxyphenyl)acetamide
Formula:	C22 H19 Cl N4 O2
SMILES:	COc1ccc(cc1)N(Cc1cccc(Cl)c1)C(=O)Cn1nnc2ccccc21
InChi:	InChI=1S/C22H19ClN4O2/c1-29-19-11-9-18(10-12-19)26(14-16-5-4-6-17(23)13-16)22(28)15-27-21-8-3-2-7-20(21)24-25-27/h2-13H,14-15H2,1H3
Definition date:	2023-08-17
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(1H-benzotriazol-1-yl)-N-[(3-chlorophenyl)methyl]-N-(4-methoxyphenyl)acetamide

3YM

3YM
Name:	3-methoxy-L-tyrosine
Formula:	C10 H13 N O4
SMILES:	O=C(O)C(N)Cc1cc(OC)c(O)cc1
InChi:	InChI=1S/C10H13NO4/c1-15-9-5-6(2-3-8(9)12)4-7(11)10(13)14/h2-3,5,7,12H,4,11H2,1H3,(H,13,14)/t7-/m0/s1
Definition date:	2012-10-29
Last modified:	2023-11-03
Release date:	2013-10-30
Identifier:	3-methoxy-L-tyrosine

ORR

ORR
Name:	1-(5-amino-3,4-dihydro-1,7-naphthyridin-1(2H)-yl)-2-(3-chlorophenyl)ethan-1-one
Formula:	C16 H16 Cl N3 O
SMILES:	Clc1cccc(c1)CC(=O)N1CCCc2c1cncc2N
InChi:	InChI=1S/C16H16ClN3O/c17-12-4-1-3-11(7-12)8-16(21)20-6-2-5-13-14(18)9-19-10-15(13)20/h1,3-4,7,9-10H,2,5-6,8,18H2
Definition date:	2023-08-17
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	1-(5-amino-3,4-dihydro-1,7-naphthyridin-1(2H)-yl)-2-(3-chlorophenyl)ethan-1-one

OSI

OSI
Name:	(4R)-6-chloro-N-(isoquinolin-4-yl)-4-methyl-3,4-dihydro-2H-1-benzopyran-4-carboxamide
Formula:	C20 H17 Cl N2 O2
SMILES:	Clc1ccc2OCCC(C)(c2c1)C(=O)Nc1cncc2ccccc21
InChi:	InChI=1S/C20H17ClN2O2/c1-20(8-9-25-18-7-6-14(21)10-16(18)20)19(24)23-17-12-22-11-13-4-2-3-5-15(13)17/h2-7,10-12H,8-9H2,1H3,(H,23,24)/t20-/m1/s1
Definition date:	2023-08-17
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(4R)-6-chloro-N-(isoquinolin-4-yl)-4-methyl-3,4-dihydro-2H-1-benzopyran-4-carboxamide

3ZH

3ZH
Name:	11-{4-[(2S)-2-amino-2-carboxyethyl]-3-(8-phenyloctyl)-2,3-dihydro-1H-imidazol-1-yl}undecanoic acid
Formula:	C31 H51 N3 O4
SMILES:	O=C(O)C(N)CC1=CN(CCCCCCCCCCC(=O)O)CN1CCCCCCCCc2ccccc2
InChi:	InChI=1S/C31H51N3O4/c32-29(31(37)38)24-28-25-33(22-16-9-5-2-1-3-8-15-21-30(35)36)26-34(28)23-17-10-6-4-7-12-18-27-19-13-11-14-20-27/h11,13-14,19-20,25,29H,1-10,12,15-18,21-24,26,32H2,(H,35,36)(H,37,38)/t29-/m0/s1
Definition date:	2014-12-12
Last modified:	2023-11-03
Release date:	2015-07-29
Identifier:	11-{4-[(2S)-2-amino-2-carboxyethyl]-3-(8-phenyloctyl)-2,3-dihydro-1H-imidazol-1-yl}undecanoic acid

OT6

OT6
Name:	2-{3-chloro-5-[(2-cyano-2-methylpropyl)amino]phenyl}-N-(4-methylpyridin-3-yl)acetamide
Formula:	C19 H21 Cl N4 O
SMILES:	O=C(Nc1cnccc1C)Cc1cc(NCC(C)(C)C#N)cc(Cl)c1
InChi:	InChI=1S/C19H21ClN4O/c1-13-4-5-22-10-17(13)24-18(25)8-14-6-15(20)9-16(7-14)23-12-19(2,3)11-21/h4-7,9-10,23H,8,12H2,1-3H3,(H,24,25)
Definition date:	2023-08-17
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-{3-chloro-5-[(2-cyano-2-methylpropyl)amino]phenyl}-N-(4-methylpyridin-3-yl)acetamide

OTV

OTV
Name:	2-(3-chloro-5-{[(1S,2R)-2-(trifluoromethyl)cyclopropyl]amino}phenyl)-N-(4-methylpyridin-3-yl)acetamide
Formula:	C18 H17 Cl F3 N3 O
SMILES:	O=C(Nc1cnccc1C)Cc1cc(NC2CC2C(F)(F)F)cc(Cl)c1
InChi:	InChI=1S/C18H17ClF3N3O/c1-10-2-3-23-9-16(10)25-17(26)6-11-4-12(19)7-13(5-11)24-15-8-14(15)18(20,21)22/h2-5,7,9,14-15,24H,6,8H2,1H3,(H,25,26)/t14-,15+/m1/s1
Definition date:	2023-08-17
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(3-chloro-5-{[(1S,2R)-2-(trifluoromethyl)cyclopropyl]amino}phenyl)-N-(4-methylpyridin-3-yl)acetamide

OTY

OTY
Name:	2-hydroxy-L-tyrosine
Formula:	C9 H11 N O4
SMILES:	O=C(O)C(N)Cc1ccc(O)cc1O
InChi:	InChI=1S/C9H11NO4/c10-7(9(13)14)3-5-1-2-6(11)4-8(5)12/h1-2,4,7,11-12H,3,10H2,(H,13,14)/t7-/m0/s1
Definition date:	2006-11-21
Last modified:	2023-11-03
Identifier:	2-hydroxy-L-tyrosine

OTZ

OTZ
Name:	2-[2-(aminomethyl)-1,3-oxazol-4-yl]-1,3-thiazole-4-carboxylic acid
Formula:	C8 H7 N3 O3 S
SMILES:	NCc1occ(n1)c2scc(n2)C(O)=O
InChi:	InChI=1S/C8H7N3O3S/c9-1-6-10-4(2-14-6)7-11-5(3-15-7)8(12)13/h2-3H,1,9H2,(H,12,13)
Definition date:	2018-06-04
Last modified:	2023-11-03
Release date:	2019-01-30
Identifier:	2-[2-(aminomethyl)-1,3-oxazol-4-yl]-1,3-thiazole-4-carboxylic acid

OUD

OUD
Name:	(3~{S})-3-azanyl-4-(carboxyamino)butanoic acid
Formula:	C5 H10 N2 O4
SMILES:	N[CH](CNC(O)=O)CC(O)=O
InChi:	InChI=1S/C5H10N2O4/c6-3(1-4(8)9)2-7-5(10)11/h3,7H,1-2,6H2,(H,8,9)(H,10,11)/t3-/m0/s1
Definition date:	2017-02-10
Last modified:	2023-11-03
Release date:	2017-04-12
Identifier:	(3~{S})-3-azanyl-4-(carboxyamino)butanoic acid

41H

41H
Name:	(betaS)-beta-methyl-L-phenylalanine
Formula:	C10 H13 N O2
SMILES:	O=C(O)C(N)C(c1ccccc1)C
InChi:	InChI=1S/C10H13NO2/c1-7(9(11)10(12)13)8-5-3-2-4-6-8/h2-7,9H,11H2,1H3,(H,12,13)/t7-,9-/m0/s1
Definition date:	2015-01-09
Last modified:	2023-11-03
Release date:	2016-02-03
Identifier:	(betaS)-beta-methyl-L-phenylalanine

OUE

OUE
Name:	(4~{S})-4-azanyl-5-(carboxyamino)pentanoic acid
Formula:	C6 H12 N2 O4
SMILES:	N[CH](CCC(O)=O)CNC(O)=O
InChi:	InChI=1S/C6H12N2O4/c7-4(1-2-5(9)10)3-8-6(11)12/h4,8H,1-3,7H2,(H,9,10)(H,11,12)/t4-/m0/s1
Definition date:	2017-02-10
Last modified:	2023-11-03
Release date:	2017-04-12
Identifier:	(4~{S})-4-azanyl-5-(carboxyamino)pentanoic acid

OUF

OUF
Name:	N-[(furan-2-yl)methyl]-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)-N-{3-[(propan-2-yl)oxy]propyl}urea
Formula:	C22 H27 N3 O4
SMILES:	O=C1c2ccccc2C(=CN1C)NC(=O)N(CCCOC(C)C)Cc1ccco1
InChi:	InChI=1S/C22H27N3O4/c1-16(2)28-13-7-11-25(14-17-8-6-12-29-17)22(27)23-20-15-24(3)21(26)19-10-5-4-9-18(19)20/h4-6,8-10,12,15-16H,7,11,13-14H2,1-3H3,(H,23,27)
Definition date:	2023-08-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-[(furan-2-yl)methyl]-N'-(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)-N-{3-[(propan-2-yl)oxy]propyl}urea

OUH

OUH
Name:	[(2~{S})-2-azanyl-3-(1~{H}-imidazol-5-yl)propyl]carbamic acid
Formula:	C7 H12 N4 O2
SMILES:	N[CH](CNC(O)=O)Cc1[nH]cnc1
InChi:	InChI=1S/C7H12N4O2/c8-5(2-10-7(12)13)1-6-3-9-4-11-6/h3-5,10H,1-2,8H2,(H,9,11)(H,12,13)/t5-/m0/s1
Definition date:	2017-02-10
Last modified:	2023-11-03
Release date:	2017-04-12
Identifier:	[(2~{S})-2-azanyl-3-(1~{H}-imidazol-5-yl)propyl]carbamic acid

OUI

OUI
Name:	[(2~{S},3~{S})-2-azanyl-3-methyl-pentyl]carbamic acid
Formula:	C7 H16 N2 O2
SMILES:	CC[CH](C)[CH](N)CNC(O)=O
InChi:	InChI=1S/C7H16N2O2/c1-3-5(2)6(8)4-9-7(10)11/h5-6,9H,3-4,8H2,1-2H3,(H,10,11)/t5-,6+/m0/s1
Definition date:	2017-02-10
Last modified:	2023-11-03
Release date:	2017-04-12
Identifier:	[(2~{S},3~{S})-2-azanyl-3-methyl-pentyl]carbamic acid

OUK

OUK
Name:	[(5~{S})-5-azanyl-6-(carboxyamino)hexyl]azanium
Formula:	C7 H18 N3 O2
SMILES:	N[CH](CCCC[NH3+])CNC(O)=O
InChi:	InChI=1S/C7H17N3O2/c8-4-2-1-3-6(9)5-10-7(11)12/h6,10H,1-5,8-9H2,(H,11,12)/p+1/t6-/m0/s1
Definition date:	2017-02-10
Last modified:	2023-11-03
Release date:	2017-04-12
Identifier:	[(5~{S})-5-azanyl-6-(carboxyamino)hexyl]azanium

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