General Information of the Compound
| Compound ID |
CP0558365
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| Compound Name |
sodium;benzenesulfonyl(1,2,3,5,6,7-hexahydro-s-indacen-4-ylcarbamoyl)azanide
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| Formula |
C19H19N2NaO3S
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| Molecular Weight |
378.429
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| Canonical SMILES |
[Na+].O=C(Nc1c2CCCc2cc2CCCc12)[N-]S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C19H20N2O3S.Na/c22-19(21-25(23,24)15-8-2-1-3-9-15)20-18-16-10-4-6-13(16)12-14-7-5-11-17(14)18;/h1-3,8-9,12H,4-7,10-11H2,(H2,20,21,22);/q;+1/p-1
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| InChIKey |
XNXHSIIEWCBYBE-UHFFFAOYSA-M
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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