SB6

4-(4-FLUOROPHENYL)-1-CYCLOROPROPYLMETHYL-5-(4-PYRIDYL)-IMIDAZOLE

Created:	1999-07-08
Last modified:	2020-06-05

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1 entries where SB6 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	38
Chiral Atom Count	0
Bond Count	41
Aromatic Bond Count	19

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Chemical Component Summary
Name	4-(4-FLUOROPHENYL)-1-CYCLOROPROPYLMETHYL-5-(4-PYRIDYL)-IMIDAZOLE
Synonyms	SB216995; PYRIDINYLIMIDAZOLE
Systematic Name (OpenEye OEToolkits)	4-[3-(cyclopropylmethyl)-5-(4-fluorophenyl)imidazol-4-yl]pyridine
Formula	C₁₈ H₁₆ F N₃
Molecular Weight	293.338
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	Fc4ccc(c1ncn(c1c2ccncc2)CC3CC3)cc4
SMILES	CACTVS	3.341	Fc1ccc(cc1)c2ncn(CC3CC3)c2c4ccncc4
SMILES	OpenEye OEToolkits	1.5.0	c1cc(ccc1c2c(n(cn2)CC3CC3)c4ccncc4)F
Canonical SMILES	CACTVS	3.341	Fc1ccc(cc1)c2ncn(CC3CC3)c2c4ccncc4
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1cc(ccc1c2c(n(cn2)CC3CC3)c4ccncc4)F
InChI	InChI	1.03	InChI=1S/C18H16FN3/c19-16-5-3-14(4-6-16)17-18(15-7-9-20-10-8-15)22(12-21-17)11-13-1-2-13/h3-10,12-13H,1-2,11H2
InChIKey	InChI	1.03	ROKOFZNQCIIJMI-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB08522
Name	4-(4-FLUOROPHENYL)-1-CYCLOROPROPYLMETHYL-5-(4-PYRIDYL)-IMIDAZOLE
Groups	experimental
Synonyms	4-(4-FLUOROPHENYL)-1-CYCLOROPROPYLMETHYL-5-(4-PYRIDYL)-IMIDAZOLE

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Mitogen-activated protein kinase 14	MSQERPTFYRQELNKTIWEVPERYQNLSPVGSGAYGSVCAAFDTKTGLRV...	unknown	inhibitor

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