General Information of the Compound
| Compound ID |
CP0283197
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| Compound Name |
US9346782, 15
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| Structure |
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| Formula |
C24H22Cl2N2OS
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| Molecular Weight |
457.426
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| Canonical SMILES |
CC(C)C(O)(c1sc(C)nc1C)c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1
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| InChI |
InChI=1S/C24H22Cl2N2OS/c1-13(2)24(29,22-14(3)27-15(4)30-22)17-10-11-19-18(12-17)21(25)20(23(26)28-19)16-8-6-5-7-9-16/h5-13,29H,1-4H3
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| InChIKey |
GBZIGVNOEFBTMY-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