General Information of the Compound
| Compound ID |
CP0505676
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| Compound Name |
N-[3-(3-aminopropyl)phenyl]benzenesulfonamide
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| Synonyms |
CHEMBL378179
N-(3-(3-aminopropyl)phenyl)benzenesulfonamide
SCHEMBL3125892
ZINC36093367
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| Structure |
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| Formula |
C15H18N2O2S
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| Molecular Weight |
290.388
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| Canonical SMILES |
NCCCc1cccc(NS(=O)(=O)c2ccccc2)c1
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| InChI |
InChI=1S/C15H18N2O2S/c16-11-5-7-13-6-4-8-14(12-13)17-20(18,19)15-9-2-1-3-10-15/h1-4,6,8-10,12,17H,5,7,11,16H2
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| InChIKey |
GTXNQXVWASTZFN-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