General Information of the Compound
| Compound ID |
CP0441236
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| Compound Name |
1-benzyl-N-[2-[methyl-[(4-pyrimidin-2-ylphenyl)methyl]amino]-2-oxoethyl]benzimidazole-2-carboxamide
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| Structure |
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| Formula |
C29H26N6O2
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| Molecular Weight |
490.567
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| Canonical SMILES |
CN(Cc1ccc(cc1)-c1ncccn1)C(=O)CNC(=O)c1nc2ccccc2n1Cc1ccccc1
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| InChI |
InChI=1S/C29H26N6O2/c1-34(19-22-12-14-23(15-13-22)27-30-16-7-17-31-27)26(36)18-32-29(37)28-33-24-10-5-6-11-25(24)35(28)20-21-8-3-2-4-9-21/h2-17H,18-20H2,1H3,(H,32,37)
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| InChIKey |
ZYOUDYPMRFJNRP-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