General Information of the Compound
| Compound ID |
CP0970414
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| Compound Name |
N-(2,2-difluoroethyl)-3-[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]azetidine-1-carboxamide
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| Structure |
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| Formula |
C20H16F5N3O
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| Molecular Weight |
409.358
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| Canonical SMILES |
O=C(NCC(F)F)N1CC(c2c(-c3ccc(F)cc3)[nH]c3c(F)cc(F)cc23)C1
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| InChI |
InChI=1S/C20H16F5N3O/c21-12-3-1-10(2-4-12)18-17(14-5-13(22)6-15(23)19(14)27-18)11-8-28(9-11)20(29)26-7-16(24)25/h1-6,11,16,27H,7-9H2,(H,26,29)
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| InChIKey |
TZTONQJWVYJZFD-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