General Information of the Compound
| Compound ID |
CP0007318
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| Compound Name |
4,6-diphenyl-N-[1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]pyrimidine-2-carboxamide
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| Structure |
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| Formula |
C28H29N7O
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| Molecular Weight |
479.588
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| Canonical SMILES |
CC(CN1CCN(CC1)c1ncccn1)NC(=O)c1nc(cc(n1)-c1ccccc1)-c1ccccc1
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| InChI |
InChI=1S/C28H29N7O/c1-21(20-34-15-17-35(18-16-34)28-29-13-8-14-30-28)31-27(36)26-32-24(22-9-4-2-5-10-22)19-25(33-26)23-11-6-3-7-12-23/h2-14,19,21H,15-18,20H2,1H3,(H,31,36)
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| InChIKey |
WEEIYDPFNLRICS-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