General Information of the Compound
| Compound ID |
CP0576058
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| Compound Name |
4-chloro-N-(1-hydroxy-3H-2,1-benzoxaborol-6-yl)-N-methylbenzenesulfonamide
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| Structure |
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| Formula |
C14H13BClNO4S
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| Molecular Weight |
337.593
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| Canonical SMILES |
CN(c1ccc2COB(O)c2c1)S(=O)(=O)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C14H13BClNO4S/c1-17(22(19,20)13-6-3-11(16)4-7-13)12-5-2-10-9-21-15(18)14(10)8-12/h2-8,18H,9H2,1H3
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| InChIKey |
ZBRZJLORLZZCPW-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