General Information of the Compound
| Compound ID |
CP0970099
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| Compound Name |
trans-3-[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]-N-[(3-methylimidazol-4-yl)methyl]cyclobutanecarboxamide
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| Formula |
C24H21F3N4O
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| Molecular Weight |
438.453
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| Canonical SMILES |
Cn1cncc1CNC(=O)[C@H]1C[C@H](c2c(-c3ccc(F)cc3)[nH]c3c(F)cc(F)cc32)C1
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| InChI |
InChI=1S/C24H21F3N4O/c1-31-12-28-10-18(31)11-29-24(32)15-6-14(7-15)21-19-8-17(26)9-20(27)23(19)30-22(21)13-2-4-16(25)5-3-13/h2-5,8-10,12,14-15,30H,6-7,11H2,1H3,(H,29,32)/t14-,15-
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| InChIKey |
CGVNARYUHZEZDN-SHTZXODSSA-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