General Information of the Compound
| Compound ID |
CP0968796
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| Compound Name |
trans-3-[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]-N-(5-methyl-2-oxo-pyrrolidin-3-yl)cyclobutanecarboxamide
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| Formula |
C24H22F3N3O2
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| Molecular Weight |
441.453
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| Canonical SMILES |
CC1CC(NC(=O)[C@H]2C[C@H](c3c(-c4ccc(F)cc4)[nH]c4c(F)cc(F)cc43)C2)C(=O)N1
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| InChI |
InChI=1S/C24H22F3N3O2/c1-11-6-19(24(32)28-11)29-23(31)14-7-13(8-14)20-17-9-16(26)10-18(27)22(17)30-21(20)12-2-4-15(25)5-3-12/h2-5,9-11,13-14,19,30H,6-8H2,1H3,(H,28,32)(H,29,31)/t11?,13-,14-,19?
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| InChIKey |
XIEYNWABOWRZKF-BUQGYACFSA-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