General Information of the Compound
| Compound ID |
CP0962777
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| Compound Name |
(5R)-N-(3,5-bis(trifluoromethyl)phenyl)-2-(2,6-dimethylphenyl)-5-methoxy-1-oxooctahydrocyclopenta[c]pyrrole-3a-carboxamide
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| Structure |
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| Formula |
C25H24F6N2O3
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| Molecular Weight |
514.466
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| Canonical SMILES |
CO[C@@H]1CC2C(=O)N(c3c(C)cccc3C)CC2(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1
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| InChI |
InChI=1S/C25H24F6N2O3/c1-13-5-4-6-14(2)20(13)33-12-23(11-18(36-3)10-19(23)21(33)34)22(35)32-17-8-15(24(26,27)28)7-16(9-17)25(29,30)31/h4-9,18-19H,10-12H2,1-3H3,(H,32,35)/t18-,19?,23?/m1/s1
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| InChIKey |
LTMHSGPFMFUUCV-MVBMGLOESA-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