General Information of the Compound
| Compound ID |
CP0512545
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| Compound Name |
US10047103, 1
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| Structure |
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| Formula |
C19H16N4O4S2
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| Molecular Weight |
428.495
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| Canonical SMILES |
COc1nn2cc(nc2s1)-c1cc2c(OCc3csc(C)n3)cc(OC)cc2o1
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| InChI |
InChI=1S/C19H16N4O4S2/c1-10-20-11(9-28-10)8-26-15-4-12(24-2)5-16-13(15)6-17(27-16)14-7-23-18(21-14)29-19(22-23)25-3/h4-7,9H,8H2,1-3H3
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| InChIKey |
MJOYITBVGFBTNC-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