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You are searching for "CFAMM00127197" in compound.
Total 1 results found.
Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.
| CFAM Mol ID | CFAMM00127197 |
| Family | CFFCD10 Integrin alpha-4 Inhibitor R1295 Family |
| Superfamily | CFSCD10 Integrin alpha-4 Inhibitor R1295 Superfamily |
| Class | CFCCD7 Class 820 |
| External ID | DCL000013 |
External Source | TTD |
| PubChem CID |
11520238 |
Functional Category |
Clinical Trial Drug |
| Molecule Name |
R1295 |
| IUPAC Name |
methyl (4S)-3-[3-[4-(3-acetamidophenyl)piperidin-1-yl]propylcarbamoyl]-4-(3,4-difluorophenyl)-6-(methoxymethyl)-2-oxo-1,4-dihydropyrimidine-5-carboxylate;hydrochloride |
| Synonyms |
SNAP-7941;CID11520238;DCL000013;DPR000109;R1295 |
| InChi |
InChI=1S/C31H37F2N5O6.ClH/c1-19(39)35-23-7-4-6-21(16-23)20-10-14-37(15-11-20)13-5-12-34-30(41)38-28(22-8-9-24(32)25(33)17-22)27(29(40)44-3)26(18-43-2)36-31(38)42;/h4,6-9,16-17,20,28H,5,10-15,18H2,1-3H3,(H,34,41)(H,35,39)(H,36,42);1H/t28-;/m0./s1 |
| InChiKey |
PRHMKHZSQPQGCD-JCOPYZAKSA-N |
| Formula | C31H38ClF2N5O6 |
Molecular Weight | 650.11 |
| Cross Link | CHEMBL2146615 |
| Structure |
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Statistics of CFAM Database |
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
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How to cite our database |
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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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Last update by |
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2014.08.29
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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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