General Information of the Compound
| Compound ID |
CP0531720
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| Compound Name |
US9434711, 789
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| Structure |
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| Formula |
C24H22F3N3O3S2
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| Molecular Weight |
521.586
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| Canonical SMILES |
CN(C)c1ccc(cn1)S(=O)(=O)N(Cc1ccc(OC(F)(F)F)cc1)c1sc2ccccc2c1C
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| InChI |
InChI=1S/C24H22F3N3O3S2/c1-16-20-6-4-5-7-21(20)34-23(16)30(15-17-8-10-18(11-9-17)33-24(25,26)27)35(31,32)19-12-13-22(28-14-19)29(2)3/h4-14H,15H2,1-3H3
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| InChIKey |
YPYSXPGUJQGEGX-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