General Information of the Compound
| Compound ID |
CP0948212
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| Compound Name |
1-(1-ethyl-2-(hydroxydiphenylmethyl)-1H-benzo[d]imidazol-6-yl)-2,2-difluoropropane-1,3-diol
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| Structure |
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| Formula |
C25H24F2N2O3
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| Molecular Weight |
438.474
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| Canonical SMILES |
CCn1c(C(O)(c2ccccc2)c2ccccc2)nc2ccc(C(O)C(F)(F)CO)cc21
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| InChI |
InChI=1S/C25H24F2N2O3/c1-2-29-21-15-17(22(31)24(26,27)16-30)13-14-20(21)28-23(29)25(32,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-15,22,30-32H,2,16H2,1H3
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| InChIKey |
YOMSRBKXSSHNSH-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