General Information of the Compound
| Compound ID |
CP0569141
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| Compound Name |
US9216968, 3
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| Structure |
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| Formula |
C23H16ClF3N4O2
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| Molecular Weight |
472.854
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| Canonical SMILES |
Cc1c(Cl)cccc1NC(=O)c1cc(NC(=O)c2ccccc2C(F)(F)F)cc2[nH]cnc12
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| InChI |
InChI=1S/C23H16ClF3N4O2/c1-12-17(24)7-4-8-18(12)31-22(33)15-9-13(10-19-20(15)29-11-28-19)30-21(32)14-5-2-3-6-16(14)23(25,26)27/h2-11H,1H3,(H,28,29)(H,30,32)(H,31,33)
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| InChIKey |
ZVSVZAHFYSIBET-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