General Information of the Compound
| Compound ID |
CP0565647
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| Compound Name |
US8969325, 304
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| Structure |
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| Formula |
C24H27ClF2N4O4
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| Molecular Weight |
508.953
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| Canonical SMILES |
CN(CCO)C1Cc2ccc(NC(=O)N[C@@H]3CC(CF)(CF)Oc4cc(Cl)ccc34)cc2NC1=O
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| InChI |
InChI=1S/C24H27ClF2N4O4/c1-31(6-7-32)20-8-14-2-4-16(10-18(14)29-22(20)33)28-23(34)30-19-11-24(12-26,13-27)35-21-9-15(25)3-5-17(19)21/h2-5,9-10,19-20,32H,6-8,11-13H2,1H3,(H,29,33)(H2,28,30,34)/t19-,20?/m1/s1
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| InChIKey |
STQDZSINJVOZLV-FIWHBWSRSA-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