General Information of the Compound
| Compound ID |
CP0969708
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| Compound Name |
3-[[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]methyl]-N-(2-oxo-1H-pyridin-3-yl)cyclobutanecarboxamide
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| Formula |
C25H20F3N3O2
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| Molecular Weight |
451.448
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| Canonical SMILES |
O=C(Nc1ccc[nH]c1=O)C1CC(Cc2c(-c3ccc(F)cc3)[nH]c3c(F)cc(F)cc23)C1
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| InChI |
InChI=1S/C25H20F3N3O2/c26-16-5-3-14(4-6-16)22-18(19-11-17(27)12-20(28)23(19)31-22)10-13-8-15(9-13)24(32)30-21-2-1-7-29-25(21)33/h1-7,11-13,15,31H,8-10H2,(H,29,33)(H,30,32)
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| InChIKey |
KOCGRJDVTYVANJ-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