General Information of the Compound
| Compound ID |
CP0573815
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| Compound Name |
US10047103, 187
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| Structure |
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| Formula |
C23H15ClN4O3S2
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| Molecular Weight |
494.985
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| Canonical SMILES |
COc1nn2cc(nc2s1)-c1cc2c(OCc3csc(n3)-c3ccccc3)cc(Cl)cc2o1
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| InChI |
InChI=1S/C23H15ClN4O3S2/c1-29-23-27-28-10-17(26-22(28)33-23)20-9-16-18(7-14(24)8-19(16)31-20)30-11-15-12-32-21(25-15)13-5-3-2-4-6-13/h2-10,12H,11H2,1H3
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| InChIKey |
VPUAKBTZRINOFW-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