General Information of the Compound
| Compound ID |
CP0542652
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| Compound Name |
N-phenyl-1-(4-phenylpyrimidin-5-yl)piperidine-4-carboxamide
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| Structure |
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| Formula |
C22H22N4O
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| Molecular Weight |
358.445
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| Canonical SMILES |
O=C(Nc1ccccc1)C1CCN(CC1)c1cncnc1-c1ccccc1
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| InChI |
InChI=1S/C22H22N4O/c27-22(25-19-9-5-2-6-10-19)18-11-13-26(14-12-18)20-15-23-16-24-21(20)17-7-3-1-4-8-17/h1-10,15-16,18H,11-14H2,(H,25,27)
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| InChIKey |
GVFAFNVKEMBJLY-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