CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00422213" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00422213
Family CFFBM13401 G-protein coupled bile acid receptor 1 ligand 1-[4-[(1R,3E)-1-(2-methylphenyl)-3-(2-methyl-1H-pyridin-4-ylidene)-3-nitrosopropyl]phenyl]piperidine-4-carboxylic acid family
Superfamily CFSBM2288 Thromboxane-A synthase and C-C chemokine receptor type 5 Binder Superfamily
Class CFCAD240 Class 240
External ID CHEMBL2407931 External Source CHEMBL
PubChem CID 58043360 Functional Category Bioactive
Molecule Name 1-[4-[(1S,3E)-1-(2-methylphenyl)-3-(2-methyl-1H-pyridin-4-ylidene)-3-nitrosopropyl]phenyl]piperidine-4-carboxylic acid
IUPAC Name 1-[4-[(1S,3E)-1-(2-methylphenyl)-3-(2-methyl-1H-pyridin-4-ylidene)-3-nitrosopropyl]phenyl]piperidine-4-carboxylic acid
InChi InChI=1S/C28H31N3O3/c1-19-5-3-4-6-25(19)26(18-27(30-34)23-11-14-29-20(2)17-23)21-7-9-24(10-8-21)31-15-12-22(13-16-31)28(32)33/h3-11,14,17,22,26,34H,12-13,15-16,18H2,1-2H3,(H,32,33)/b30-27+/t26-/m0/s1
Formula C28H31N3O3 Molecular Weight 457.56
Cross Link CHEMBL2407931

Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

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