General Information of the Compound
| Compound ID |
CP0386320
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| Compound Name |
2-[4-[(4-bromoanilino)sulfamoyl]phenoxy]acetic acid
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| Structure |
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| Formula |
C14H13BrN2O5S
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| Molecular Weight |
401.238
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| Canonical SMILES |
OC(=O)COc1ccc(cc1)S(=O)(=O)NNc1ccc(Br)cc1
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| InChI |
InChI=1S/C14H13BrN2O5S/c15-10-1-3-11(4-2-10)16-17-23(20,21)13-7-5-12(6-8-13)22-9-14(18)19/h1-8,16-17H,9H2,(H,18,19)
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| InChIKey |
JRANKDFHLDTFGH-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