BP4

biphenyl-4-ylacetic acid

Created:	2002-08-23
Last modified:	2024-09-27

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3 entries where BP4 is found as a standalone ligand1 entries where BP4 is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	28
Chiral Atom Count	0
Bond Count	29
Aromatic Bond Count	13

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Chemical Component Summary
Name	biphenyl-4-ylacetic acid
Systematic Name (OpenEye OEToolkits)	2-(4-phenylphenyl)ethanoic acid
Formula	C₁₄ H₁₂ O₂
Molecular Weight	212.244
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(O)Cc1ccc(cc1)c2ccccc2
SMILES	CACTVS	3.370	OC(=O)Cc1ccc(cc1)c2ccccc2
SMILES	OpenEye OEToolkits	1.7.0	c1ccc(cc1)c2ccc(cc2)CC(=O)O
Canonical SMILES	CACTVS	3.370	OC(=O)Cc1ccc(cc1)c2ccccc2
Canonical SMILES	OpenEye OEToolkits	1.7.0	c1ccc(cc1)c2ccc(cc2)CC(=O)O
InChI	InChI	1.03	InChI=1S/C14H12O2/c15-14(16)10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10H2,(H,15,16)
InChIKey	InChI	1.03	QRZAKQDHEVVFRX-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB07477
Name	Felbinac
Groups	experimental
Synonyms	Felbinac
Categories	Acids, Carbocyclic Agents causing hyperkalemia Agents that produce hypertension Analgesics Analgesics, Non-Narcotic Anti-Inflammatory Agents Anti-Inflammatory Agents, Non-Steroidal Antiinflammatory Preparations, Non-Steroids for Topical Use Antirheumatic Agents Musculo-Skeletal System Nephrotoxic agents Non COX-2 selective NSAIDS Peripheral Nervous System Agents Sensory System Agents Topical Products for Joint and Muscular Pain
ATC-Code	M02AA08
CAS number	5728-52-9

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Cathepsin L1	MNPTLILAAFCLGIASATLTFDHSLEAQWTKWKAMHNRLYGMNEEGWRRA...	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