General Information of the Compound
| Compound ID |
CP0946778
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| Compound Name |
3-(1-ethyl-2-(hydroxydiphenylmethyl)-1H-benzo[d]imidazol-6-yloxy)propan-1-ol
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| Structure |
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| Formula |
C25H26N2O3
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| Molecular Weight |
402.494
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| Canonical SMILES |
CCn1c(C(O)(c2ccccc2)c2ccccc2)nc2ccc(OCCCO)cc21
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| InChI |
InChI=1S/C25H26N2O3/c1-2-27-23-18-21(30-17-9-16-28)14-15-22(23)26-24(27)25(29,19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-8,10-15,18,28-29H,2,9,16-17H2,1H3
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| InChIKey |
NSQDKNLYTBXFAD-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