CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00331073" 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 CFAMM00331073
Family CFFBM2175 C-C chemokine receptor type 3 ligand 1-(3-cyanophenyl)-3-[6-[[4-[(4-fluorophenyl)methyl]-1-methylpiperidin-1-ium-1-yl]methyl]-1,3-benzodioxol-5-yl]urea;iodide family
Superfamily CFSBM1213 Cholinesterase and DNA polymerase beta Binder Superfamily
Class CFCBM207 Class 3257
External ID CHEMBL123616 External Source CHEMBL
PubChem CID 11006581 Functional Category Bioactive
Molecule Name 1-[6-[(4-benzyl-1-methylpiperidin-1-ium-1-yl)methyl]-1,3-benzodioxol-5-yl]-3-(3-cyanophenyl)urea;iodide
IUPAC Name 1-[6-[(4-benzyl-1-methylpiperidin-1-ium-1-yl)methyl]-1,3-benzodioxol-5-yl]-3-(3-cyanophenyl)urea;iodide
Synonyms CHEBI:305915
InChi InChI=1S/C29H30N4O3.HI/c1-33(12-10-22(11-13-33)14-21-6-3-2-4-7-21)19-24-16-27-28(36-20-35-27)17-26(24)32-29(34)31-25-9-5-8-23(15-25)18-30;/h2-9,15-17,22H,10-14,19-20H2,1H3,(H-,31,32,34);1H
Formula C29H31N4O3.I Molecular Weight 610.49
Cross Link CHEMBL123616

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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