92G

4-(2-amino-1,3-thiazol-4-yl)phenol

Created:	2009-01-20
Last modified:	2011-06-04

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2 entries where 92G is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	21
Chiral Atom Count	0
Bond Count	22
Aromatic Bond Count	12

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Chemical Component Summary
Name	4-(2-amino-1,3-thiazol-4-yl)phenol
Systematic Name (OpenEye OEToolkits)	4-(2-amino-1,3-thiazol-4-yl)phenol
Formula	C₉ H₈ N₂ O S
Molecular Weight	192.238
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	n2c(c1ccc(O)cc1)csc2N
SMILES	CACTVS	3.341	Nc1scc(n1)c2ccc(O)cc2
SMILES	OpenEye OEToolkits	1.5.0	c1cc(ccc1c2csc(n2)N)O
Canonical SMILES	CACTVS	3.341	Nc1scc(n1)c2ccc(O)cc2
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1cc(ccc1c2csc(n2)N)O
InChI	InChI	1.03	InChI=1S/C9H8N2OS/c10-9-11-8(5-13-9)6-1-3-7(12)4-2-6/h1-5,12H,(H2,10,11)
InChIKey	InChI	1.03	QGSJYYIRAFRPIT-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB07292
Name	4-(2-amino-1,3-thiazol-4-yl)phenol
Groups	experimental
Synonyms	4-(2-amino-1,3-thiazol-4-yl)phenol

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Leukotriene A-4 hydrolase	MPEIVDTCSLASPASVCRTKHLHLRCSVDFTRRTLTGTAALTVQSQEDNL...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682