General Information of the Compound
| Compound ID |
CP0418319
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| Compound Name |
US9192603, 52
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| Structure |
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| Formula |
C19H15F2N3O3S2
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| Molecular Weight |
435.477
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| Canonical SMILES |
Fc1ccc(CS(=O)(=O)c2sc(NC(=O)c3ccccn3)nc2C2CC2)c(F)c1
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| InChI |
InChI=1S/C19H15F2N3O3S2/c20-13-7-6-12(14(21)9-13)10-29(26,27)18-16(11-4-5-11)23-19(28-18)24-17(25)15-3-1-2-8-22-15/h1-3,6-9,11H,4-5,10H2,(H,23,24,25)
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| InChIKey |
MLPORFGIKZXOQH-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