CFAM Mol ID	CFAMM00408821
Family	CFFBM11378 Dipeptidyl peptidase 4 inhibitor 2-[(3R)-3-aminopiperidin-1-yl]-3-[(2-chlorophenyl)methyl]-5-methyl-4-oxoimidazo[4,5-c]quinoline-7-carboxylic acid;hydrochloride family
Superfamily	CFSBM2964 Dipeptidyl peptidase 4 and 5-hydroxytryptamine receptor 4 Binder Superfamily
Class	CFCCD247 Class 1060
External ID	CHEMBL2147085	External Source	CHEMBL
PubChem CID	71456392	Functional Category	Bioactive
Molecule Name	2-[2-[(3R)-3-aminopiperidin-1-yl]-3-[(2-chlorophenyl)methyl]-5-methyl-4-oxoimidazo[4,5-c]quinolin-9-yl]acetic acid;hydrochloride
IUPAC Name	2-[2-[(3R)-3-aminopiperidin-1-yl]-3-[(2-chlorophenyl)methyl]-5-methyl-4-oxoimidazo[4,5-c]quinolin-9-yl]acetic acid;hydrochloride
Synonyms
InChi	InChI=1S/C25H26ClN5O3.ClH/c1-29-19-10-4-7-15(12-20(32)33)21(19)22-23(24(29)34)31(13-16-6-2-3-9-18(16)26)25(28-22)30-11-5-8-17(27)14-30;/h2-4,6-7,9-10,17H,5,8,11-14,27H2,1H3,(H,32,33);1H/t17-;/m1./s1
InChiKey	DYKZGZLGIFPQIN-UNTBIKODSA-N
Formula	C25H27Cl2N5O3	Molecular Weight	516.42
Cross Link	CHEMBL2147085
Structure

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).

Last update by

2014.08.29

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore

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