Details of the Drug

General Information of Drug (ID: DMGYZHU)

• Drug Name: Methyl 10H-phenothiazine-10-carboxylate
• Synonyms: methyl 10H-phenothiazine-10-carboxylate; CHEMBL480755; methyl phenothiazine-10-carboxylate; Phenothiazine-10-carboxylic acid methyl ester; AC1MJ71I; SCHEMBL8739119; MolPort-001-898-173; ZINC4007353; STK373134; BDBM50292600; AKOS005447210; MCULE-7901457115; BAS 00444618; 68825-31-0; ST50909034; 10H-Phenothiazine-10-carboxylic acid methyl ester; SR-01000320795; SR-01000320795-1; 10H-Phenothiazine-10-carboxylic acid, methyl ester

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]

• Drug Type: Small molecular drug
• #Ro5 Violations (Lipinski): 0:
  Molecular Weight (mw); 257.31
  Logarithm of the Partition Coefficient (xlogp); 3.4
  Rotatable Bond Count (rotbonds); 1
  Hydrogen Bond Donor Count (hbonddonor); 0
  Hydrogen Bond Acceptor Count (hbondacc); 3
• Chemical Identifiers:
  Formula: C14H11NO2S
  IUPAC Name: methyl phenothiazine-10-carboxylate
  Canonical SMILES: COC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31
  InChI: InChI=1S/C14H11NO2S/c1-17-14(16)15-10-6-2-4-8-12(10)18-13-9-5-3-7-11(13)15/h2-9H,1H3
  InChIKey: WWHYODNLUNCVDI-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 3107576
  TTD ID: D07AYF

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Cholinesterase (BCHE)	TTEB0GD	CHLE_HUMAN	Inhibitor	[1]

References

• [1] Carbamates with differential mechanism of inhibition toward acetylcholinesterase and butyrylcholinesterase. J Med Chem. 2008 Jul 24;51(14):4200-12.