General Information of the Compound
| Compound ID |
CP0482430
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| Compound Name |
N-[1-(1-benzylimidazol-2-yl)-2-(7-methyl-1H-indazol-5-yl)ethyl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide
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| Structure |
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| Formula |
C34H36N8O2
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| Molecular Weight |
588.716
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| Canonical SMILES |
Cc1cc(CC(NC(=O)N2CCC(CC2)N2Cc3ccccc3NC2=O)c2nccn2Cc2ccccc2)cc2cn[nH]c12
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| InChI |
InChI=1S/C34H36N8O2/c1-23-17-25(18-27-20-36-39-31(23)27)19-30(32-35-13-16-41(32)21-24-7-3-2-4-8-24)38-33(43)40-14-11-28(12-15-40)42-22-26-9-5-6-10-29(26)37-34(42)44/h2-10,13,16-18,20,28,30H,11-12,14-15,19,21-22H2,1H3,(H,36,39)(H,37,44)(H,38,43)
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| InChIKey |
FKCJGQMMOGKLEI-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