General Information of the Compound
| Compound ID |
CP0398761
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| Compound Name |
N,N-dimethyl-N'-[5-[(4-methylphenyl)sulfonylamino]-1,2-benzothiazol-3-yl]methanimidamide
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| Formula |
C17H18N4O2S2
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| Molecular Weight |
374.491
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| Canonical SMILES |
CN(C)\C=N\c1nsc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc12
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| InChI |
InChI=1S/C17H18N4O2S2/c1-12-4-7-14(8-5-12)25(22,23)20-13-6-9-16-15(10-13)17(19-24-16)18-11-21(2)3/h4-11,20H,1-3H3/b18-11+
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| InChIKey |
VLWVTYHKCATYLC-WOJGMQOQSA-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