General Information of the Compound
| Compound ID |
CP0378281
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| Compound Name |
(E)-N-(4-(4-(4-chlorophenyl)piperidin-1-yl)butyl)-3-(3,4,5-trifluorophenyl)acrylamide
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| Structure |
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| Formula |
C24H26ClF3N2O
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| Molecular Weight |
450.932
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| Canonical SMILES |
Fc1cc(\C=C\C(=O)NCCCCN2CCC(CC2)c2ccc(Cl)cc2)cc(F)c1F
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| InChI |
InChI=1S/C24H26ClF3N2O/c25-20-6-4-18(5-7-20)19-9-13-30(14-10-19)12-2-1-11-29-23(31)8-3-17-15-21(26)24(28)22(27)16-17/h3-8,15-16,19H,1-2,9-14H2,(H,29,31)/b8-3+
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| InChIKey |
MMZZJZKWUFWNDC-FPYGCLRLSA-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