General Information of the Compound
| Compound ID |
CP0526860
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| Compound Name |
2-(2,3-dihydro-1H-inden-5-yl)-N-[[2-(4-methylpiperidin-1-yl)-6-(trifluoromethyl)pyridin-3-yl]methyl]propanamide
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| Structure |
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| Formula |
C25H30F3N3O
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| Molecular Weight |
445.529
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| Canonical SMILES |
CC(C(=O)NCc1ccc(nc1N1CCC(C)CC1)C(F)(F)F)c1ccc2CCCc2c1
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| InChI |
InChI=1S/C25H30F3N3O/c1-16-10-12-31(13-11-16)23-21(8-9-22(30-23)25(26,27)28)15-29-24(32)17(2)19-7-6-18-4-3-5-20(18)14-19/h6-9,14,16-17H,3-5,10-13,15H2,1-2H3,(H,29,32)
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| InChIKey |
ZHARXLBUEWQDMD-UHFFFAOYSA-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