General Information of the Compound
| Compound ID |
CP0953187
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| Compound Name |
3-[[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]methyl]-N-(2-methylsulfonylethyl)cyclobutanecarboxamide
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| Formula |
C23H23F3N2O3S
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| Molecular Weight |
464.509
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| Canonical SMILES |
CS(=O)(=O)CCNC(=O)C1CC(Cc2c(-c3ccc(F)cc3)[nH]c3c(F)cc(F)cc23)C1
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| InChI |
InChI=1S/C23H23F3N2O3S/c1-32(30,31)7-6-27-23(29)15-8-13(9-15)10-18-19-11-17(25)12-20(26)22(19)28-21(18)14-2-4-16(24)5-3-14/h2-5,11-13,15,28H,6-10H2,1H3,(H,27,29)
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| InChIKey |
BHCAHPRDDQAQKQ-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