General Information of the Compound
| Compound ID |
CP0516235
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| Compound Name |
US8614253, 36-3
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| Structure |
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| Formula |
C10H12BrNO2S
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| Molecular Weight |
290.182
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| Canonical SMILES |
COc1cc(Br)cc(C2NCCS2)c1O
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| InChI |
InChI=1S/C10H12BrNO2S/c1-14-8-5-6(11)4-7(9(8)13)10-12-2-3-15-10/h4-5,10,12-13H,2-3H2,1H3
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| InChIKey |
GTTMAAKFNJFEQG-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