General Information of the Compound
| Compound ID |
CP0968444
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| Compound Name |
1-ethyl-2-(hydroxydiphenylmethyl)-N-((tetrahydro-2H-pyran-4-yl)methyl)-1H-benzo[d]imidazole-6-carboxamide
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| Structure |
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| Formula |
C29H31N3O3
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| Molecular Weight |
469.585
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| Canonical SMILES |
CCn1c(C(O)(c2ccccc2)c2ccccc2)nc2ccc(C(=O)NCC3CCOCC3)cc21
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| InChI |
InChI=1S/C29H31N3O3/c1-2-32-26-19-22(27(33)30-20-21-15-17-35-18-16-21)13-14-25(26)31-28(32)29(34,23-9-5-3-6-10-23)24-11-7-4-8-12-24/h3-14,19,21,34H,2,15-18,20H2,1H3,(H,30,33)
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| InChIKey |
QZWJZUPRFDWSBA-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