Details of the Drug

General Information of Drug (ID: DMY6NIT)

• Drug Name: 2-Phenyl-3-piperidin-3-yl-1H-indole
• Synonyms: CHEMBL42557; 2-Phenyl-3-piperidin-3-yl-1H-indole; 2-phenyl-3-(3-piperidinyl)-1H-Indole; SCHEMBL8525019; BDBM50099262; AKOS022450446; 3-(3-Piperidinyl)-2-phenyl-1H-indole; 244086-74-6; 3-(Piperidin-3-yl)-2-phenyl-1H-indole; DA-07759

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); 276.4
  Logarithm of the Partition Coefficient (xlogp); 3.8
  Rotatable Bond Count (rotbonds); 2
  Hydrogen Bond Donor Count (hbonddonor); 2
  Hydrogen Bond Acceptor Count (hbondacc); 1
• Chemical Identifiers:
  Formula: C19H20N2
  IUPAC Name: 2-phenyl-3-piperidin-3-yl-1H-indole
  Canonical SMILES: C1CC(CNC1)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4
  InChI: InChI=1S/C19H20N2/c1-2-7-14(8-3-1)19-18(15-9-6-12-20-13-15)16-10-4-5-11-17(16)21-19/h1-5,7-8,10-11,15,20-21H,6,9,12-13H2
  InChIKey: FYHCOUIJWCQUMZ-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 9795587
  ChEBI ID: CHEMBL42557
  TTD ID: D0RC9T
• Drug-Molecule Activity Atlas (DMA)NEW: Click to Jump to the Detailed DMA Information of This Drug
• Drug ADMET Endpoint Profile (DAE)NEW: Click to Jump to the Detailed DAE Information of This Drug

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Voltage-gated potassium channel Kv11.1 (KCNH2)	TTQ6VDM	KCNH2_HUMAN	Inhibitor	[1]

References

• [1] 3-(4-Fluoropiperidin-3-yl)-2-phenylindoles as high affinity, selective, and orally bioavailable h5-HT(2A) receptor antagonists. J Med Chem. 2001 May 10;44(10):1603-14.