General Information of the Compound
| Compound ID |
CP0887702
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| Compound Name |
2-(bis(4-fluorophenyl)(hydroxy)methyl)-N-(2-hydroxypentyl)-1-methyl-1H-benzo[d]imidazole-6-carboxamide
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| Structure |
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| Formula |
C27H27F2N3O3
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| Molecular Weight |
479.527
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| Canonical SMILES |
CCCC(O)CNC(=O)c1ccc2nc(C(O)(c3ccc(F)cc3)c3ccc(F)cc3)n(C)c2c1
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| InChI |
InChI=1S/C27H27F2N3O3/c1-3-4-22(33)16-30-25(34)17-5-14-23-24(15-17)32(2)26(31-23)27(35,18-6-10-20(28)11-7-18)19-8-12-21(29)13-9-19/h5-15,22,33,35H,3-4,16H2,1-2H3,(H,30,34)
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| InChIKey |
LBPOJVRXWRBBDU-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