General Information of the Compound
| Compound ID |
CP0504165
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| Compound Name |
1-benzyl-N-[2-[methyl-[[4-(1,3-thiazol-2-yl)phenyl]methyl]amino]-2-oxoethyl]benzimidazole-2-carboxamide
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| Structure |
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| Formula |
C28H25N5O2S
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| Molecular Weight |
495.608
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| Canonical SMILES |
CN(Cc1ccc(cc1)-c1nccs1)C(=O)CNC(=O)c1nc2ccccc2n1Cc1ccccc1
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| InChI |
InChI=1S/C28H25N5O2S/c1-32(18-21-11-13-22(14-12-21)28-29-15-16-36-28)25(34)17-30-27(35)26-31-23-9-5-6-10-24(23)33(26)19-20-7-3-2-4-8-20/h2-16H,17-19H2,1H3,(H,30,35)
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| InChIKey |
KMYYXNZFDDEWMA-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