General Information of the Compound
| Compound ID |
CP0476377
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| Compound Name |
1-benzyl-N-(3-(4-(1-methylpiperidin-4-yl)piperazin-1-yl)-3-oxopropyl)-1H-benzo[d]imidazole-2-carboxamide
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| Structure |
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| Formula |
C28H36N6O2
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| Molecular Weight |
488.636
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| Canonical SMILES |
CN1CCC(CC1)N1CCN(CC1)C(=O)CCNC(=O)c1nc2ccccc2n1Cc1ccccc1
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| InChI |
InChI=1S/C28H36N6O2/c1-31-15-12-23(13-16-31)32-17-19-33(20-18-32)26(35)11-14-29-28(36)27-30-24-9-5-6-10-25(24)34(27)21-22-7-3-2-4-8-22/h2-10,23H,11-21H2,1H3,(H,29,36)
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| InChIKey |
CCDPIPBMPBOSKQ-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