SIB-1893   Click here for help

GtoPdb Ligand ID: 1432

Synonyms: SIB1893
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 0
Rotatable bonds 2
Topological polar surface area 12.89
Molecular weight 195.1
XLogP 3.39
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES Cc1cccc(n1)C=Cc1ccccc1
Isomeric SMILES Cc1cccc(n1)/C=C/c1ccccc1
InChI InChI=1S/C14H13N/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13/h2-11H,1H3/b11-10+
InChI Key SISOFUCTXZKSOQ-ZHACJKMWSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
2-methyl-6-(2-phenylethenyl)pyridine
Synonyms Click here for help
SIB1893
Database Links Click here for help
BindingDB Ligand 50084141
CAS Registry No. 7370-21-0 (source: Scifinder)
ChEMBL Ligand CHEMBL88612
GtoPdb PubChem SID 135651042
PubChem CID 5311432
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Wikipedia SIB-1893

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Tocris
SIB 1757
Cat. No. 1215