General Information of the Compound
| Compound ID |
CP0489196
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| Compound Name |
2-[[4-[(3-methylanilino)sulfamoyl]benzoyl]amino]acetic acid
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| Structure |
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| Formula |
C16H17N3O5S
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| Molecular Weight |
363.395
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| Canonical SMILES |
Cc1cccc(NNS(=O)(=O)c2ccc(cc2)C(=O)NCC(O)=O)c1
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| InChI |
InChI=1S/C16H17N3O5S/c1-11-3-2-4-13(9-11)18-19-25(23,24)14-7-5-12(6-8-14)16(22)17-10-15(20)21/h2-9,18-19H,10H2,1H3,(H,17,22)(H,20,21)
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| InChIKey |
LRSJQQKSYNVCRU-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