General Information of the Compound
| Compound ID |
CP0955363
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| Compound Name |
N-(2-amino-2-oxo-ethyl)-3-[7-fluoro-2-(4-fluorophenyl)-5-(trifluoromethyl)-1H-indol-3-yl]cyclobutanecarboxamide
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| Formula |
C22H18F5N3O2
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| Molecular Weight |
451.395
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| Canonical SMILES |
NC(=O)CNC(=O)C1CC(c2c(-c3ccc(F)cc3)[nH]c3c(F)cc(C(F)(F)F)cc23)C1
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| InChI |
InChI=1S/C22H18F5N3O2/c23-14-3-1-10(2-4-14)19-18(11-5-12(6-11)21(32)29-9-17(28)31)15-7-13(22(25,26)27)8-16(24)20(15)30-19/h1-4,7-8,11-12,30H,5-6,9H2,(H2,28,31)(H,29,32)
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| InChIKey |
VJKOZAPKZUWBCX-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