General Information of the Compound
| Compound ID |
CP0499584
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| Compound Name |
2-(3-phenylthio)phenyl)-1-aminoethane
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| Synonyms |
2-(3-(Phenylthio)Phenyl)Ethanamine
2-(3-phenylthio)phenyl)-1-aminoethane
BDBM50193470
CHEMBL211688
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| Structure |
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| Formula |
C14H15NS
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| Molecular Weight |
229.348
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| Canonical SMILES |
NCCc1cccc(Sc2ccccc2)c1
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| InChI |
InChI=1S/C14H15NS/c15-10-9-12-5-4-8-14(11-12)16-13-6-2-1-3-7-13/h1-8,11H,9-10,15H2
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| InChIKey |
FJLQSSVQBNJTEU-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: PT00939, 5-hydroxytryptamine receptor 2C
Protein ID: PT01354, 5-hydroxytryptamine receptor 6
Clinical Information about the Compound