C4F

3-(3-methoxybenzyl)-1H-pyrrolo[2,3-b]pyridine

Created:	2008-01-30
Last modified:	2011-06-04

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1 entries where C4F is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	32
Chiral Atom Count	0
Bond Count	34
Aromatic Bond Count	16

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Chemical Component Summary
Name	3-(3-methoxybenzyl)-1H-pyrrolo[2,3-b]pyridine
Systematic Name (OpenEye OEToolkits)	3-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine
Formula	C₁₅ H₁₄ N₂ O
Molecular Weight	238.284
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	n1cccc2c1ncc2Cc3cccc(OC)c3
SMILES	CACTVS	3.341	COc1cccc(Cc2c[nH]c3ncccc23)c1
SMILES	OpenEye OEToolkits	1.5.0	COc1cccc(c1)Cc2c[nH]c3c2cccn3
Canonical SMILES	CACTVS	3.341	COc1cccc(Cc2c[nH]c3ncccc23)c1
Canonical SMILES	OpenEye OEToolkits	1.5.0	COc1cccc(c1)Cc2c[nH]c3c2cccn3
InChI	InChI	1.03	InChI=1S/C15H14N2O/c1-18-13-5-2-4-11(9-13)8-12-10-17-15-14(12)6-3-7-16-15/h2-7,9-10H,8H2,1H3,(H,16,17)
InChIKey	InChI	1.03	GHQCCHWTDLTMJT-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB07525
Name	3-(3-methoxybenzyl)-1H-pyrrolo[2,3-b]pyridine
Groups	experimental
Synonyms	3-(3-methoxybenzyl)-1H-pyrrolo[2,3-b]pyridine

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Fibroblast growth factor receptor 1	MWSWKCLLFWAVLVTATLCTARPSPTLPEQAQPWGAPVEVESFLVHPGDL...	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