General Information of the Compound
| Compound ID |
CP0295462
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| Compound Name |
1,1,1-trifluoro-N-[5-(1-methylpyrazol-4-yl)-2-oxo-7-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-14-yl]methanesulfonamide
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| Structure |
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| Formula |
C19H13F3N4O3S
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| Molecular Weight |
434.399
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| Canonical SMILES |
Cn1cc(cn1)-c1cnc2ccc3ccc(NS(=O)(=O)C(F)(F)F)cc3c(=O)c2c1
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| InChI |
InChI=1S/C19H13F3N4O3S/c1-26-10-13(9-24-26)12-6-16-17(23-8-12)5-3-11-2-4-14(7-15(11)18(16)27)25-30(28,29)19(20,21)22/h2-10,25H,1H3
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| InChIKey |
PWEWKROHMINCBH-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