CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00388035" in compound.

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CFAM Mol ID CFAMM00388035
Family CFFBM8451 Dipeptidyl peptidase 8 inhibitor (2S)-2-amino-4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-1-(5-fluoro-1,3-dihydroisoindol-2-yl)butane-1,4-dione;2,2,2-trifluoroacetic acid family
Superfamily CFSCD302 Substance-P receptor Ligand Orvepitant Superfamily
Class CFCCD223 Class 1036
External ID CHEMBL1814748 External Source CHEMBL
PubChem CID 56671893 Functional Category Bioactive
Molecule Name (2S)-2-amino-4-[(3S)-4-[bis(4-fluorophenyl)methyl]-3-methylpiperazin-1-yl]-1-(1,3-dihydroisoindol-2-yl)butane-1,4-dione;2,2,2-trifluoroacetic acid
IUPAC Name (2S)-2-amino-4-[(3S)-4-[bis(4-fluorophenyl)methyl]-3-methylpiperazin-1-yl]-1-(1,3-dihydroisoindol-2-yl)butane-1,4-dione;2,2,2-trifluoroacetic acid
InChi InChI=1S/C30H32F2N4O2.C2HF3O2/c1-20-17-34(28(37)16-27(33)30(38)35-18-23-4-2-3-5-24(23)19-35)14-15-36(20)29(21-6-10-25(31)11-7-21)22-8-12-26(32)13-9-22;3-2(4,5)1(6)7/h2-13,20,27,29H,14-19,33H2,1H3;(H,6,7)/t20-,27-;/m0./s1
Formula C32H33F5N4O4 Molecular Weight 632.62
Cross Link CHEMBL1814748

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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