General Information of the Compound
| Compound ID |
CP0946769
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| Compound Name |
2-cyano-N-(1-ethyl-2-(hydroxydiphenylmethyl)-1H-benzo[d]imidazol-6-yl)acetamide
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| Structure |
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| Formula |
C25H22N4O2
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| Molecular Weight |
410.477
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| Canonical SMILES |
CCn1c(C(O)(c2ccccc2)c2ccccc2)nc2ccc(NC(=O)CC#N)cc21
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| InChI |
InChI=1S/C25H22N4O2/c1-2-29-22-17-20(27-23(30)15-16-26)13-14-21(22)28-24(29)25(31,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-14,17,31H,2,15H2,1H3,(H,27,30)
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| InChIKey |
PKHPSQBYIUZMEJ-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