General Information of the Compound
| Compound ID |
CP0969297
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| Compound Name |
cis-3-[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]-N-(2,6-dioxo-3-piperidyl)cyclobutanecarboxamide
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| Formula |
C24H20F3N3O3
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| Molecular Weight |
455.436
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| Canonical SMILES |
O=C1CCC(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/C24H20F3N3O3/c25-14-3-1-11(2-4-14)21-20(16-9-15(26)10-17(27)22(16)30-21)12-7-13(8-12)23(32)28-18-5-6-19(31)29-24(18)33/h1-4,9-10,12-13,18,30H,5-8H2,(H,28,32)(H,29,31,33)/t12-,13+,18?
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| InChIKey |
BALNAFWGKUZBHT-NCNPBXTDSA-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