General Information of the Compound
| Compound ID |
CP0960804
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| Compound Name |
3-[7-fluoro-2-(4-fluorophenyl)-5-(trifluoromethyl)-1H-indol-3-yl]-N-(2-hydroxyethyl)cyclobutanecarboxamide
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| Formula |
C22H19F5N2O2
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| Molecular Weight |
438.396
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| Canonical SMILES |
O=C(NCCO)C1CC(c2c(-c3ccc(F)cc3)[nH]c3c(F)cc(C(F)(F)F)cc23)C1
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| InChI |
InChI=1S/C22H19F5N2O2/c23-15-3-1-11(2-4-15)19-18(12-7-13(8-12)21(31)28-5-6-30)16-9-14(22(25,26)27)10-17(24)20(16)29-19/h1-4,9-10,12-13,29-30H,5-8H2,(H,28,31)
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| InChIKey |
UNHAOWNOBTYBPZ-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