Compound: felbinac
SMILES: O=C(O)Cc1ccc(-c2ccccc2)cc1
InChIKey: QRZAKQDHEVVFRX-UHFFFAOYSA-N
Synonyms: felbinac, 4-BIPHENYLACETIC ACID, 5728-52-9, Traxam, Dolinac, Napageln, biphenyl-4-ylacetic acid, 4-Carboxymethylbiphenyl, p-Biphenylylacetic acid, Felbinaco, Felbinacum, LJC 10,141, L-141, LJC-10141, Flexfree, Ly-61017, NSC-16284, 94WNJ5U8L7, CL-83544, DTXSID0045389, CHEBI:31597, CL 83,544, DTXCID8025389, [1,1'-Biphenyl]-4-ylacetic acid, (1,1'-biphenyl)-4-ylacetic acid, RefChem:140075, M02AA08, 227-233-2, 4-Biphenylylacetic acid, 2-(4-phenylphenyl)acetic acid, Seltouch, [1,1'-Biphenyl]-4-acetic acid, p-Biphenylacetic acid, Biphenyl-4-acetic acid, 4-Biphenylaceticacid, Acetic acid, (4-biphenylyl)-, 2-([1,1'-biphenyl]-4-yl)acetic acid, CL 83544, LY 61017, (1,1'-Biphenyl)-4-acetic acid, MFCD00004351, NSC 16284, 4-phenylphenylacetic acid, MLS000069466, 2-(biphenyl-4-yl)acetic acid, NCGC00016660-01, 2-{[1,1'-biphenyl]-4-yl}acetic acid, SMR000059071, CAS-5728-52-9, Felbinacum [Latin], Felbinaco [Spanish], Selspot, Sumilu, Felbinac; (Biphenyl-4-yl)acetic acid, Biphenyl-4-yl-acetic acid, (Biphenyl-4-yl)acetic acid, Felbinac [USAN:INN:BAN:JAN], EINECS 227-233-2, BRN 1211592, UNII-94WNJ5U8L7, Dolonac, Ledergel, Napagel, L 141, Felbinac CRS, Zenol EXUM, BP4, Dolinac (TN), Felbinac (Standard), Felbinac Impurity 2, BPAA, EMEC, 4-biphenyl acetic acid, 4-biphenyl-acetic acid, FELBINAC [USAN], Opera_ID_534, FELBINAC [INN], FELBINAC [JAN], FELBINAC [MI], 4-biphenylyl acetic acid, Prestwick0_000893, Prestwick1_000893, Prestwick2_000893, Prestwick3_000893, (4'-biphenyl)acetic acid, Epitope ID:613405, FELBINAC [WHO-DD], Oprea1_058748, SCHEMBL26084, BSPBio_000706, 4-Biphenylacetic acid, 98%, 4-Biphenylacetic acid(methoxymethyl)-1,1'-biphenyl, SPBio_002915, 4-[l,l'biphenyl]ylacetic acid, BPBio1_000778, CHEMBL413965, Felbinac (JP18/USAN/INN), orb1310198, SCHEMBL1510273, SCHEMBL5746957, FELBINAC [EP MONOGRAPH], 1,1'-biphenyl-4-ylacetic acid, HY-B0641R, HFN-310, BDBM223312, HMS1570D08, HMS2097D08, HMS3714D08, HMS5081P18, Pharmakon1600-01506160, CS-D1194, HY-B0641, NSC16284, Tox21_110549, AR1730, EBC-04197, NSC760372, s3685, SBB056750, STK387569, AKOS000119696, Tox21_110549_1, ([1,1'-Biphenyl]-4-yl)acetic acid, [1,1'-Biphenyl]-4-ylacetic acid #, AC-8104, AS-2883, CCG-213621, CS-8026, DB07477, FF23234, NSC-760372, NCGC00016660-02, NCGC00016660-03, NCGC00016660-04, NCGC00016660-06, DB-022648, AB00384278, B1278, NS00008983, ST50308310, T0888, EN300-20102, D01675, AB00384278_14, F018235, SR-01000003008, 4-Biphenylacetic acid(Discontinued,See C4X-25282), Q3742067, SR-01000003008-2, BRD-K91740057-001-16-4, BRD-K91740057-001-19-8, F2191-0076, Felbinac, European Pharmacopoeia (EP) Reference Standard, Z104476858
Theoretical properties:
molecular_formula: C14H12O2
molecular_weight: 212.24 g/mol
exact_mass: 212.083729621 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 3
heavy_atom_count: 16
topological_polar_surface_area: 37.3 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Biphenyl-4-ylacetic acid is a monocarboxylic acid in which one of the alpha-hydrogens is substituted by a biphenyl-4-yl group. An active metabolite of fenbufen, it is used as a topical medicine to treat muscle inflammation and arthritis. It has a role as a non-steroidal anti-inflammatory drug. It is a member of biphenyls and a monocarboxylic acid. It contains a biphenyl-4-yl group. It is functionally related to an acetic acid.
chebi: A monocarboxylic acid in which one of the α-hydrogens is substituted by a biphenyl-4-yl group. An active metabolite of fenbufen, it is used as a topical medicine to treat muscle inflammation and arthritis.
chembl: FELBINAC is a small molecule listed in the ChEMBL database and has reached clinical trial phase 3.0.
wikipedia: Felbinac (INN, or biphenylylacetic acid) is a topical medicine, belonging to the family of medicines known as nonsteroidal anti-inflammatory drugs (NSAIDs) of the arylacetic acid (not arylpropionic acid) class, which is used to treat muscle inflammation and arthritis. It is an active metabolite of fenbufen.