General Information of the Compound
| Compound ID |
CP0910244
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| Compound Name |
1-ethyl-2-(hydroxydiphenylmethyl)-N-(1-(2-hydroxypropyl)-1H-pyrazol-4-yl)-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 |
CCn1c(C(O)(c2ccccc2)c2ccccc2)nc2ccc(C(=O)Nc3cnn(CC(C)O)c3)cc21
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| InChI |
InChI=1S/C29H29N5O3/c1-3-34-26-16-21(27(36)31-24-17-30-33(19-24)18-20(2)35)14-15-25(26)32-28(34)29(37,22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-17,19-20,35,37H,3,18H2,1-2H3,(H,31,36)
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| InChIKey |
VXXMLJXRXNUPPQ-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