General Information of the Compound
| Compound ID |
CP0948260
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| Compound Name |
N-(1-ethyl-1H-pyrazol-3-yl)-2-(hydroxydiphenylmethyl)-1-(2-methoxyethyl)-1H-benzo[d]imidazole-6-carboxamide
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| Structure |
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| Formula |
C29H29N5O3
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| Molecular Weight |
495.583
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| Canonical SMILES |
CCn1ccc(NC(=O)c2ccc3nc(C(O)(c4ccccc4)c4ccccc4)n(CCOC)c3c2)n1
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| InChI |
InChI=1S/C29H29N5O3/c1-3-33-17-16-26(32-33)31-27(35)21-14-15-24-25(20-21)34(18-19-37-2)28(30-24)29(36,22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-17,20,36H,3,18-19H2,1-2H3,(H,31,32,35)
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| InChIKey |
SMQUOPXEIOUYLA-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