General Information of the Compound
| Compound ID |
CP0874664
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| Compound Name |
(S)-1-ethyl-N-(1-ethylpiperidin-3-yl)-2-(hydroxydiphenylmethyl)-1H-benzo[d]imidazole-6-carboxamide
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| Structure |
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| Formula |
C30H34N4O2
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| Molecular Weight |
482.628
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| Canonical SMILES |
CCN1CCC[C@H](NC(=O)c2ccc3nc(C(O)(c4ccccc4)c4ccccc4)n(CC)c3c2)C1
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| InChI |
InChI=1S/C30H34N4O2/c1-3-33-19-11-16-25(21-33)31-28(35)22-17-18-26-27(20-22)34(4-2)29(32-26)30(36,23-12-7-5-8-13-23)24-14-9-6-10-15-24/h5-10,12-15,17-18,20,25,36H,3-4,11,16,19,21H2,1-2H3,(H,31,35)/t25-/m0/s1
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| InChIKey |
QSINCKMUFCVCGS-VWLOTQADSA-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