General Information of the Compound
| Compound ID |
CP0470308
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| Compound Name |
US9120756, 29
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| Structure |
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| Formula |
C24H27ClF2N4O3S
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| Molecular Weight |
525.021
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| Canonical SMILES |
CC(C(=O)NCc1cc(nn1-c1cccc(Cl)c1)C(C)(C)C)c1cc(F)c(NS(C)(=O)=O)c(F)c1
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| InChI |
InChI=1S/C24H27ClF2N4O3S/c1-14(15-9-19(26)22(20(27)10-15)30-35(5,33)34)23(32)28-13-18-12-21(24(2,3)4)29-31(18)17-8-6-7-16(25)11-17/h6-12,14,30H,13H2,1-5H3,(H,28,32)
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| InChIKey |
DELQFXWCIMXPIS-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