General Information of the Compound
| Compound ID |
CP0968602
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| Compound Name |
3-[[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]methyl]-N-(3-furylmethyl)cyclobutanecarboxamide
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| Formula |
C25H21F3N2O2
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| Molecular Weight |
438.449
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| Canonical SMILES |
O=C(NCc1ccoc1)C1CC(Cc2c(-c3ccc(F)cc3)[nH]c3c(F)cc(F)cc23)C1
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| InChI |
InChI=1S/C25H21F3N2O2/c26-18-3-1-16(2-4-18)23-20(21-10-19(27)11-22(28)24(21)30-23)9-15-7-17(8-15)25(31)29-12-14-5-6-32-13-14/h1-6,10-11,13,15,17,30H,7-9,12H2,(H,29,31)
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| InChIKey |
CTSVIIGMJVYICW-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