[3H]SCH-23390   Click here for help

GtoPdb Ligand ID: 946

Synonyms: [3H]-SCH23390
 Ligand is labelled  Ligand is radioactive
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 23.47
Molecular weight 287.11
XLogP 3.48
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CN1CCc2c(C(C1)c1ccccc1)cc(c(c2)Cl)O
Isomeric SMILES CN1CCc2c(C(C1)c1ccccc1)cc(c(c2)Cl)O
InChI InChI=1S/C17H18ClNO/c1-19-8-7-13-9-16(18)17(20)10-14(13)15(11-19)12-5-3-2-4-6-12/h2-6,9-10,15,20H,7-8,11H2,1H3
InChI Key GOTMKOSCLKVOGG-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
7-chloro-3-methyl-1-phenyl-1,2,4,5-tetrahydro-3-benzazepin-8-ol
Synonyms Click here for help
[3H]-SCH23390
Database Links Click here for help
ChEMBL Ligand CHEMBL13668
GtoPdb PubChem SID 135651204
PubChem CID 5018
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