General Information of the Compound
| Compound ID |
CP0563868
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| Compound Name |
US9067935, 74
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| Structure |
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| Formula |
C24H19Cl2F4N5O3S
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| Molecular Weight |
604.413
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| Canonical SMILES |
Fc1cc(CN(c2nc3ccc(Cl)cn3c2Cl)S(=O)(=O)c2ccc(nc2)N2CCOCC2)ccc1C(F)(F)F
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| InChI |
InChI=1S/C24H19Cl2F4N5O3S/c25-16-2-5-21-32-23(22(26)34(21)14-16)35(13-15-1-4-18(19(27)11-15)24(28,29)30)39(36,37)17-3-6-20(31-12-17)33-7-9-38-10-8-33/h1-6,11-12,14H,7-10,13H2
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| InChIKey |
MXXUPZVCCFPVTN-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