General Information of the Compound
| Compound ID |
CP0970403
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| Compound Name |
3-[[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]methyl]-N-[(1,5-dimethylpyrazol-3-yl)methyl]cyclobutanecarboxamide
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| Structure |
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| Formula |
C26H25F3N4O
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| Molecular Weight |
466.507
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| Canonical SMILES |
Cc1cc(CNC(=O)C2CC(Cc3c(-c4ccc(F)cc4)[nH]c4c(F)cc(F)cc34)C2)nn1C
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| InChI |
InChI=1S/C26H25F3N4O/c1-14-7-20(32-33(14)2)13-30-26(34)17-8-15(9-17)10-21-22-11-19(28)12-23(29)25(22)31-24(21)16-3-5-18(27)6-4-16/h3-7,11-12,15,17,31H,8-10,13H2,1-2H3,(H,30,34)
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| InChIKey |
QDXGCPJZBGGGHY-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