General Information of the Compound
| Compound ID |
CP0433340
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| Compound Name |
3-(3-bromo-phenylamino)-7-chloro-1,1-dioxo-1,4-dihydro-1lambda6-benzo[1,2,4]thiadiazin-5-ol
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| Structure |
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| Formula |
C13H9BrClN3O3S
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| Molecular Weight |
402.657
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| Canonical SMILES |
Oc1cc(Cl)cc2c1N=C(Nc1cccc(Br)c1)NS2(=O)=O
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| InChI |
InChI=1S/C13H9BrClN3O3S/c14-7-2-1-3-9(4-7)16-13-17-12-10(19)5-8(15)6-11(12)22(20,21)18-13/h1-6,19H,(H2,16,17,18)
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| InChIKey |
UODZJYIOOOSYBW-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