General Information of the Compound
| Compound ID |
CP0913709
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| Compound Name |
2-(hydroxydiphenylmethyl)-1-(2-hydroxyethyl)-N-(1-methyl-1H-pyrazol-4-yl)-1H-benzo[d]imidazole-6-carboxamide
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| Structure |
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| Formula |
C27H25N5O3
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| Molecular Weight |
467.529
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| Canonical SMILES |
Cn1cc(NC(=O)c2ccc3nc(C(O)(c4ccccc4)c4ccccc4)n(CCO)c3c2)cn1
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| InChI |
InChI=1S/C27H25N5O3/c1-31-18-22(17-28-31)29-25(34)19-12-13-23-24(16-19)32(14-15-33)26(30-23)27(35,20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-13,16-18,33,35H,14-15H2,1H3,(H,29,34)
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| InChIKey |
DXDVMFJTQLEMLJ-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