General Information of the Compound
| Compound ID |
CP0570107
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| Compound Name |
2-[bis(2-fluorophenyl)-hydroxymethyl]-1-ethyl-N-(1-ethyl-1,2,4-triazol-3-yl)-5-methoxyimidazo[4,5-b]pyridine-6-carboxamide
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| Formula |
C27H25F2N7O3
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| Molecular Weight |
533.539
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| Canonical SMILES |
CCn1cnc(NC(=O)c2cc3n(CC)c(nc3nc2OC)C(O)(c2ccccc2F)c2ccccc2F)n1
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| InChI |
InChI=1S/C27H25F2N7O3/c1-4-35-15-30-26(34-35)33-23(37)16-14-21-22(31-24(16)39-3)32-25(36(21)5-2)27(38,17-10-6-8-12-19(17)28)18-11-7-9-13-20(18)29/h6-15,38H,4-5H2,1-3H3,(H,33,34,37)
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| InChIKey |
ILOZSKZWTJTARE-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