luzindole   Click here for help

GtoPdb Ligand ID: 1363

Synonyms: 2-benzyl-N-acetyltryptamine | N0774
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 44.89
Molecular weight 292.16
XLogP 3.45
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CC(=O)NCCc1c(Cc2ccccc2)[nH]c2c1cccc2
Isomeric SMILES CC(=O)NCCc1c(Cc2ccccc2)[nH]c2c1cccc2
InChI InChI=1S/C19H20N2O/c1-14(22)20-12-11-17-16-9-5-6-10-18(16)21-19(17)13-15-7-3-2-4-8-15/h2-10,21H,11-13H2,1H3,(H,20,22)
InChI Key WVVXBPKOIZGVNS-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
N-[2-[2-(phenylmethyl)-1H-indol-3-yl]ethyl]acetamide
Synonyms Click here for help
2-benzyl-N-acetyltryptamine | N0774
Database Links Click here for help
CAS Registry No. 117946-91-5 (source: Scifinder)
ChEMBL Ligand CHEMBL286615
GtoPdb PubChem SID 135650539
PubChem CID 122162
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Tocris
Luzindole
Cat. No. 0877