General Information of the Compound
| Compound ID |
CP0963976
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| Compound Name |
trans-3-[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]-N-(5-methylisoxazol-3-yl)cyclobutanecarboxamide
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| Formula |
C23H18F3N3O2
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| Molecular Weight |
425.41
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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)no1
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| InChI |
InChI=1S/C23H18F3N3O2/c1-11-6-19(29-31-11)27-23(30)14-7-13(8-14)20-17-9-16(25)10-18(26)22(17)28-21(20)12-2-4-15(24)5-3-12/h2-6,9-10,13-14,28H,7-8H2,1H3,(H,27,29,30)/t13-,14-
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| InChIKey |
FWKUDSSRCGPUOL-HDJSIYSDSA-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