GQP

1-[(4-fluorophenyl)methyl]benzimidazole

Created:	2018-05-31
Last modified:	2018-10-10

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4 entries where GQP is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	28
Chiral Atom Count	0
Bond Count	30
Aromatic Bond Count	16

2D diagram of GQP

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Chemical Component Summary
Name	1-[(4-fluorophenyl)methyl]benzimidazole
Systematic Name (OpenEye OEToolkits)	1-[(4-fluorophenyl)methyl]benzimidazole
Formula	C₁₄ H₁₁ F N₂
Molecular Weight	226.249
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Fc1ccc(Cn2cnc3ccccc23)cc1
SMILES	OpenEye OEToolkits	2.0.6	c1ccc2c(c1)ncn2Cc3ccc(cc3)F
Canonical SMILES	CACTVS	3.385	Fc1ccc(Cn2cnc3ccccc23)cc1
Canonical SMILES	OpenEye OEToolkits	2.0.6	c1ccc2c(c1)ncn2Cc3ccc(cc3)F
InChI	InChI	1.03	InChI=1S/C14H11FN2/c15-12-7-5-11(6-8-12)9-17-10-16-13-3-1-2-4-14(13)17/h1-8,10H,9H2
InChIKey	InChI	1.03	QLQZBMMYHJKDSH-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	755572
ChEMBL	CHEMBL1541796

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.