General Information of the Compound
| Compound ID |
CP0529151
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| Compound Name |
1-benzyl-N-[2-[methyl-[[4-(piperidin-1-ylmethyl)phenyl]methyl]amino]-2-oxoethyl]benzimidazole-2-carboxamide
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| Structure |
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| Formula |
C31H35N5O2
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| Molecular Weight |
509.654
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| Canonical SMILES |
CN(Cc1ccc(CN2CCCCC2)cc1)C(=O)CNC(=O)c1nc2ccccc2n1Cc1ccccc1
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| InChI |
InChI=1S/C31H35N5O2/c1-34(21-25-14-16-26(17-15-25)22-35-18-8-3-9-19-35)29(37)20-32-31(38)30-33-27-12-6-7-13-28(27)36(30)23-24-10-4-2-5-11-24/h2,4-7,10-17H,3,8-9,18-23H2,1H3,(H,32,38)
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| InChIKey |
RPJDNSHQYKDQRX-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