General Information of the Compound
| Compound ID |
CP0420781
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| Compound Name |
N-(2,5-dimethylphenyl)-3-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]propanamide
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| Structure |
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| Formula |
C19H21N3O5S
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| Molecular Weight |
403.46
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| Canonical SMILES |
Cc1ccc(C)c(NC(=O)CCNS(=O)(=O)c2ccc3n(C)c(=O)oc3c2)c1
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| InChI |
InChI=1S/C19H21N3O5S/c1-12-4-5-13(2)15(10-12)21-18(23)8-9-20-28(25,26)14-6-7-16-17(11-14)27-19(24)22(16)3/h4-7,10-11,20H,8-9H2,1-3H3,(H,21,23)
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| InChIKey |
QNHOZZHLZQCIPU-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
Protein ID: PT05210, Alkaline phosphatase, placental type
Protein ID: PT01329, Alkaline phosphatase, tissue-nonspecific isozyme
Protein ID: PT06212, Intestinal-type alkaline phosphatase