General Information of the Compound
| Compound ID |
CP0425962
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| Compound Name |
N-[2-[[1-[4-(3-methylphenyl)cyclohexyl]piperidin-4-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C28H34F3N3O2
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| Molecular Weight |
501.593
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| Canonical SMILES |
Cc1cccc(c1)C1CCC(CC1)N1CCC(CC1)NC(=O)CNC(=O)c1cccc(c1)C(F)(F)F
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| InChI |
InChI=1S/C28H34F3N3O2/c1-19-4-2-5-21(16-19)20-8-10-25(11-9-20)34-14-12-24(13-15-34)33-26(35)18-32-27(36)22-6-3-7-23(17-22)28(29,30)31/h2-7,16-17,20,24-25H,8-15,18H2,1H3,(H,32,36)(H,33,35)
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| InChIKey |
QRBXMDBNEZLTCE-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