General Information of the Compound
| Compound ID |
CP0381473
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| Compound Name |
N-[4,6-bis[(E)-2-phenylethenyl]pyrimidin-2-yl]propanamide
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| Structure |
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| Formula |
C23H21N3O
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| Molecular Weight |
355.441
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| Canonical SMILES |
CCC(=O)Nc1nc(\C=C\c2ccccc2)cc(\C=C\c2ccccc2)n1
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| InChI |
InChI=1S/C23H21N3O/c1-2-22(27)26-23-24-20(15-13-18-9-5-3-6-10-18)17-21(25-23)16-14-19-11-7-4-8-12-19/h3-17H,2H2,1H3,(H,24,25,26,27)/b15-13+,16-14+
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| InChIKey |
GYFHZTLFNMVEDV-WXUKJITCSA-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