General Information of the Compound
| Compound ID |
CP0969167
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| Compound Name |
2-((4-fluorophenyl)(3-fluoropyridin-2-yl)(hydroxy)methyl)-N-((R)-2-hydroxypropyl)-1-methyl-1H-benzo[d]imidazole-6-carboxamide
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| Structure |
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| Formula |
C24H22F2N4O3
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| Molecular Weight |
452.461
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| Canonical SMILES |
C[C@@H](O)CNC(=O)c1ccc2nc(C(O)(c3ccc(F)cc3)c3ncccc3F)n(C)c2c1
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| InChI |
InChI=1S/C24H22F2N4O3/c1-14(31)13-28-22(32)15-5-10-19-20(12-15)30(2)23(29-19)24(33,16-6-8-17(25)9-7-16)21-18(26)4-3-11-27-21/h3-12,14,31,33H,13H2,1-2H3,(H,28,32)/t14-,24?/m1/s1
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| InChIKey |
LAQZQCHAMGVXBX-GMBBYQRISA-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