Details of the Drug

General Information of Drug (ID: DM49YTN)

• Drug Name: (3r)-1-Acetyl-3-Methylpiperidine
• Synonyms: (3R)-1-ACETYL-3-METHYLPIPERIDINE; 1-[(3R)-3-methylpiperidin-1-yl]ethanone; 1P3; 1w8l; AC1L9MR1; SCHEMBL4309663; ZINC389643; DB01742

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); 141.21
  Logarithm of the Partition Coefficient (xlogp); 1
  Rotatable Bond Count (rotbonds); 0
  Hydrogen Bond Donor Count (hbonddonor); 0
  Hydrogen Bond Acceptor Count (hbondacc); 1
• Chemical Identifiers:
  Formula: C8H15NO
  IUPAC Name: 1-[(3R)-3-methylpiperidin-1-yl]ethanone
  Canonical SMILES: C[C@@H]1CCCN(C1)C(=O)C
  InChI: InChI=1S/C8H15NO/c1-7-4-3-5-9(6-7)8(2)10/h7H,3-6H2,1-2H3/t7-/m1/s1
  InChIKey: XKFPNHDGLSYZRC-SSDOTTSWSA-N
• Cross-matching ID:
  PubChem CID: 449120
  DrugBank ID: DB01742
  TTD ID: D0DQ4D

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Rotamase A (PPIA)	TTL2ADK	PPIA_HUMAN	Inhibitor	[1]

References

• [1] How many drug targets are there Nat Rev Drug Discov. 2006 Dec;5(12):993-6.