CFam Chemical Families Database
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You are searching for "CFAMM00033896" in compound.

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CFAM Mol ID CFAMM00033896
Family CFFAD188 D(2) dopamine receptor Ligand Nemonapride Family
Superfamily CFSAD176 D(2) dopamine receptor Ligand Nemonapride Superfamily
Class CFCAD171 Class 171
External ID CHEMBL198719 External Source CHEMBL
PubChem CID 44404958 Functional Category Bioactive
Molecule Name AGN-PC-075XXA
IUPAC Name 2-[4-[6-[[1-[2-(4-amino-5-chloro-2-methoxybenzoyl)oxyethyl]piperidine-4-carbonyl]amino]hexanoylamino]piperidin-1-yl]ethyl 4-amino-5-chloro-2-hydroxybenzoate
Synonyms CHEBI:431336;2-[4-[6-[[1-[2-(4-amino-5-chloro-2-methoxybenzoyl)oxyethyl]piperidine-4-carbonyl]amino]hexanoylamino]piperidin-1-yl]ethyl 4-amino-5-chloro-2-hydroxybenzoate
InChi InChI=1S/C36H50Cl2N6O8/c1-50-32-22-30(40)28(38)20-26(32)36(49)52-18-15-43-11-6-23(7-12-43)34(47)41-10-4-2-3-5-33(46)42-24-8-13-44(14-9-24)16-17-51-35(48)25-19-27(37)29(39)21-31(25)45/h19-24,45H,2-18,39-40H2,1H3,(H,41,47)(H,42,46)
Formula C36H50Cl2N6O8 Molecular Weight 765.72
Cross Link CHEMBL198719

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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