General Information of the Compound
| Compound ID |
CP0469579
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| Compound Name |
1-(4-chlorophenyl)-N-[2-[4-hydroxy-4-(trifluoromethyl)piperidin-1-yl]-3-phenylpropyl]cyclopropane-1-carboxamide
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| Structure |
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| Formula |
C25H28ClF3N2O2
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| Molecular Weight |
480.958
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| Canonical SMILES |
OC1(CCN(CC1)C(CNC(=O)C1(CC1)c1ccc(Cl)cc1)Cc1ccccc1)C(F)(F)F
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| InChI |
InChI=1S/C25H28ClF3N2O2/c26-20-8-6-19(7-9-20)23(10-11-23)22(32)30-17-21(16-18-4-2-1-3-5-18)31-14-12-24(33,13-15-31)25(27,28)29/h1-9,21,33H,10-17H2,(H,30,32)
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| InChIKey |
SGEZELHMEQVNFY-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