General Information of the Compound
| Compound ID |
CP0887691
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| Compound Name |
(S)-N-(1-ethyl-6-oxopiperidin-3-yl)-2-(hydroxydiphenylmethyl)-1-methyl-1H-benzo[d]imidazole-6-carboxamide
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| Structure |
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| Formula |
C29H30N4O3
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| Molecular Weight |
482.584
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| Canonical SMILES |
CCN1C[C@@H](NC(=O)c2ccc3nc(C(O)(c4ccccc4)c4ccccc4)n(C)c3c2)CCC1=O
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| InChI |
InChI=1S/C29H30N4O3/c1-3-33-19-23(15-17-26(33)34)30-27(35)20-14-16-24-25(18-20)32(2)28(31-24)29(36,21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-14,16,18,23,36H,3,15,17,19H2,1-2H3,(H,30,35)/t23-/m0/s1
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| InChIKey |
IUAJMDFDLMHLLZ-QHCPKHFHSA-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