CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00129167" 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 CFAMM00129167
Family CFFCD24 C-X-C chemokine receptor type 4 Ligand AMD-070 Family
Superfamily CFSAD209 Toll-like receptor 7 Ligand Imiquimod Superfamily
Class CFCAD202 Class 202
External ID CHEMBL1630623 External Source CHEMBL
PubChem CID 53325663 Functional Category Bioactive
Molecule Name 2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-N-[4-(trifluoromethyl)phenyl]-7-[3-(trifluoromethyl)pyridin-2-yl]-5,6,8,9-tetrahydropyrimido[4,5-d]azepin-4-amine
IUPAC Name 2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-N-[4-(trifluoromethyl)phenyl]-7-[3-(trifluoromethyl)pyridin-2-yl]-5,6,8,9-tetrahydropyrimido[4,5-d]azepin-4-amine
Synonyms CHEBI:1152801
InChi InChI=1S/C27H29F6N7/c1-38(2)19-9-13-40(16-19)25-36-22-11-15-39(24-21(27(31,32)33)4-3-12-34-24)14-10-20(22)23(37-25)35-18-7-5-17(6-8-18)26(28,29)30/h3-8,12,19H,9-11,13-16H2,1-2H3,(H,35,36,37)/t19-/m1/s1
Formula C27H29F6N7 Molecular Weight 565.56
Cross Link CHEMBL1630623

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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