General Information of the Compound
| Compound ID |
CP0009923
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| Compound Name |
5-piperidin-1-yl-N-[5-[4-(trifluoromethyl)phenyl]-1H-pyrazol-3-yl]pentanamide
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| Structure |
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| Formula |
C20H25F3N4O
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| Molecular Weight |
394.441
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| Canonical SMILES |
FC(F)(F)c1ccc(cc1)-c1cc(NC(=O)CCCCN2CCCCC2)[nH]n1
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| InChI |
InChI=1S/C20H25F3N4O/c21-20(22,23)16-9-7-15(8-10-16)17-14-18(26-25-17)24-19(28)6-2-5-13-27-11-3-1-4-12-27/h7-10,14H,1-6,11-13H2,(H2,24,25,26,28)
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| InChIKey |
AEZVYNVHNCDBQX-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