1-methyl-4-methylthio-β-carboline

AlkaPlorer ID: AK109068

Synonym: '1-methyl-4-methylthio-β-carboline'

IUPAC Name: 1-methyl-4-methylsulfanyl-9H-pyrido[3,4-b]indole

Structure

SMILES: CSC1=CN=C(C)C2=C1C1=CC=CC=C1N2

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InChI: InChI=1S/C13H12N2S/c1-8-13-12(11(16-2)7-14-8)9-5-3-4-6-10(9)15-13/h3-7,15H,1-2H3

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InChIKey: ARIRIEWSAQZIMQ-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 228.32

TPSA: 28.68

MolLogP: 3.7464200000000014

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information