General Information of the Compound
| Compound ID |
CP0416927
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| Compound Name |
N-[3-(2-aminoethyl)phenyl]benzenesulfonamide
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| Synonyms |
BDBM50193463
CHEMBL212063
N-(3-(2-aminoethyl)phenyl)benzenesulfonamide
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| Structure |
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| Formula |
C14H16N2O2S
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| Molecular Weight |
276.361
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| Canonical SMILES |
NCCc1cccc(NS(=O)(=O)c2ccccc2)c1
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| InChI |
InChI=1S/C14H16N2O2S/c15-10-9-12-5-4-6-13(11-12)16-19(17,18)14-7-2-1-3-8-14/h1-8,11,16H,9-10,15H2
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| InChIKey |
SMDOJINITBXUQJ-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
Clinical Information about the Compound