General Information of the Compound
| Compound ID |
CP0969989
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| Compound Name |
N-(2-acetamidoethyl)-3-[[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]methyl]cyclobutanecarboxamide
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| Formula |
C24H24F3N3O2
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| Molecular Weight |
443.469
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| Canonical SMILES |
CC(=O)NCCNC(=O)C1CC(Cc2c(-c3ccc(F)cc3)[nH]c3c(F)cc(F)cc23)C1
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| InChI |
InChI=1S/C24H24F3N3O2/c1-13(31)28-6-7-29-24(32)16-8-14(9-16)10-19-20-11-18(26)12-21(27)23(20)30-22(19)15-2-4-17(25)5-3-15/h2-5,11-12,14,16,30H,6-10H2,1H3,(H,28,31)(H,29,32)
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| InChIKey |
OFLNYPZOUIZVFR-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