General Information of the Compound
| Compound ID |
CP0550170
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| Compound Name |
(3S)-N-[(4-chlorophenyl)-[4-(trifluoromethoxy)phenyl]methyl]-5-oxopyrrolidine-3-carboxamide
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| Formula |
C19H16ClF3N2O3
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| Molecular Weight |
412.795
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| Canonical SMILES |
FC(F)(F)Oc1ccc(cc1)C(NC(=O)[C@@H]1CNC(=O)C1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C19H16ClF3N2O3/c20-14-5-1-11(2-6-14)17(25-18(27)13-9-16(26)24-10-13)12-3-7-15(8-4-12)28-19(21,22)23/h1-8,13,17H,9-10H2,(H,24,26)(H,25,27)/t13-,17?/m0/s1
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| InChIKey |
WUBBFNQDAVWSFT-CWQZNGJJSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound