General Information of the Compound
| Compound ID |
CP0375854
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| Compound Name |
1-[(4-methylmorpholin-2-yl)methyl]-3-phenyl-2lambda6,1,3-benzothiadiazole 2,2-dioxide
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| Structure |
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| Formula |
C18H21N3O3S
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| Molecular Weight |
359.451
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| Canonical SMILES |
CN1CCOC(CN2c3ccccc3N(c3ccccc3)S2(=O)=O)C1
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| InChI |
InChI=1S/C18H21N3O3S/c1-19-11-12-24-16(13-19)14-20-17-9-5-6-10-18(17)21(25(20,22)23)15-7-3-2-4-8-15/h2-10,16H,11-14H2,1H3
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| InChIKey |
HRZCVADZOIJDCK-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