General Information of the Compound
| Compound ID |
CP0966070
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| Compound Name |
3-[[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]methyl]-N-(3-oxo-1,2-dihydropyrazol-4-yl)cyclobutanecarboxamide
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| Formula |
C23H19F3N4O2
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| Molecular Weight |
440.425
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| Canonical SMILES |
O=C(Nc1c[nH][nH]c1=O)C1CC(Cc2c(-c3ccc(F)cc3)[nH]c3c(F)cc(F)cc23)C1
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| InChI |
InChI=1S/C23H19F3N4O2/c24-14-3-1-12(2-4-14)20-16(17-8-15(25)9-18(26)21(17)29-20)7-11-5-13(6-11)22(31)28-19-10-27-30-23(19)32/h1-4,8-11,13,29H,5-7H2,(H,28,31)(H2,27,30,32)
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| InChIKey |
YDTLIHOFYROKPM-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