General Information of the Compound
| Compound ID |
CP0443806
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| Compound Name |
N-[5-(4-propan-2-ylpiperazin-1-yl)pyridin-2-yl]-4-pyridin-2-ylbenzamide
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| Structure |
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| Formula |
C24H27N5O
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| Molecular Weight |
401.514
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| Canonical SMILES |
CC(C)N1CCN(CC1)c1ccc(NC(=O)c2ccc(cc2)-c2ccccn2)nc1
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| InChI |
InChI=1S/C24H27N5O/c1-18(2)28-13-15-29(16-14-28)21-10-11-23(26-17-21)27-24(30)20-8-6-19(7-9-20)22-5-3-4-12-25-22/h3-12,17-18H,13-16H2,1-2H3,(H,26,27,30)
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| InChIKey |
LAXDQTSFVDFBFM-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