Bioactive Compound Details

BioIDbio3128
NamePROCYCLIDINE
ChEMBL IDCHEMBL86715
Molecular FormulaC19H29NO
Molecular Weight287.45
Molecular Weight (Monoisotopic)287.2249
TypeSmall molecule
Max PhasePhase 4
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsELORINE|KEMADRINE|LERGINE|NSC-169103|PROCICLIDINA|PROCYCLIDINE|TRICOLOID|VAGOSIN
SmilesOC(CCN1CCCC1)(c1ccccc1)C1CCCCC1
InchiInChI=1S/C19H29NO/c21-19(17-9-3-1-4-10-17,18-11-5-2-6-12-18)13-16-20-14-7-8-15-20/h1,3-4,9-10,18,21H,2,5-8,11-16H2
Inchi KeyWYDUSKDSKCASEF-UHFFFAOYSA-N
Molecular SpeciesBASE
Targets71.0
Bioactivities118.0
Np Likeness Score-0.45
Records Key['147', 'procyclidin', '83, procyclidine', 'procyclidine', 'Procyclidine', 'Procyclidine', 'Procyclidine', 'procyclidine', '1692', '(+/-)-procyclidine', 'procyclidine', 'Procyclidine', 'procyclidine', 'PROCYCLIDINE', 'Procyclidine', 'COVC-0677820189', 'PROCYCLIDINE HYDROCHLORIDE', 'procyclidine', 'BA1000116']
Records Name['1-Cyclohexyl-1-phenyl-3-pyrrolidin-1-yl-propan-1-ol', '(S)-1-cyclohexyl-1-phenyl-3-(pyrrolidin-1-yl)propan-1-ol', '1,1-diphenyl-3-(pyrrolidin-1-yl)propan-1-ol', 'Procyclidine', 'Procyclidine', 'Procyclidine', 'Procyclidine', 'procyclidine', None, '1-Cyclohexyl-1-phenyl-3-pyrrolidin-1-yl-propan-1-ol', 'procyclidine', 'Procyclidine', 'procyclidine', 'PROCYCLIDINE', 'Procyclidine', 'PROCYCLIDINE', 'PROCYCLIDINE HYDROCHLORIDE', 'procyclidine', 'PROCYCLIDINE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure