General Information of the Compound
| Compound ID |
CP0549198
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| Compound Name |
N'-(4-bromophenyl)-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonohydrazide
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| Structure |
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| Formula |
C16H16BrN3O3S
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| Molecular Weight |
410.293
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| Canonical SMILES |
Brc1ccc(NNS(=O)(=O)c2ccc3NC(=O)CCCc3c2)cc1
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| InChI |
InChI=1S/C16H16BrN3O3S/c17-12-4-6-13(7-5-12)19-20-24(22,23)14-8-9-15-11(10-14)2-1-3-16(21)18-15/h4-10,19-20H,1-3H2,(H,18,21)
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| InChIKey |
DQJJIJMDSUPRAV-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