1HP

4-(2-amino-1-methyl-1H-imidazo[4,5-b]pyridin-6-yl)phenol

Created:	2007-08-15
Last modified:	2011-06-04

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1 entries where 1HP is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	30
Chiral Atom Count	0
Bond Count	32
Aromatic Bond Count	17

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Chemical Component Summary
Name	4-(2-amino-1-methyl-1H-imidazo[4,5-b]pyridin-6-yl)phenol
Systematic Name (OpenEye OEToolkits)	4-(2-amino-1-methyl-imidazo[5,4-e]pyridin-6-yl)phenol
Formula	C₁₃ H₁₂ N₄ O
Molecular Weight	240.261
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	n1cc(cc2c1nc(n2C)N)c3ccc(O)cc3
SMILES	CACTVS	3.341	Cn1c(N)nc2ncc(cc12)c3ccc(O)cc3
SMILES	OpenEye OEToolkits	1.5.0	Cn1c2cc(cnc2nc1N)c3ccc(cc3)O
Canonical SMILES	CACTVS	3.341	Cn1c(N)nc2ncc(cc12)c3ccc(O)cc3
Canonical SMILES	OpenEye OEToolkits	1.5.0	Cn1c2cc(cnc2nc1N)c3ccc(cc3)O
InChI	InChI	1.03	InChI=1S/C13H12N4O/c1-17-11-6-9(7-15-12(11)16-13(17)14)8-2-4-10(18)5-3-8/h2-7,18H,1H3,(H2,14,15,16)
InChIKey	InChI	1.03	UGJXOCBVCWTJFP-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB06898
Name	4-(2-amino-1-methyl-1H-imidazo[4,5-b]pyridin-6-yl)phenol
Groups	experimental
Synonyms	4-(2-amino-1-methyl-1H-imidazo[4,5-b]pyridin-6-yl)phenol

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Estrogen receptor alpha	MTMTLHTKASGMALLHQIQGNELEPLNRPQLKIPLERPLGEVYLDSSKPA...	unknown
Nuclear receptor coactivator 2	MSGMGENTSDPSRAETRKRKECPDQLGPSPKRNTEKRNREQENKYIEELA...	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