Bioactive Compound Details

BioIDbio198291
NamePHYSOSTIGMINE SULFATE
ChEMBL IDCHEMBL2105891
Molecular FormulaC30H44N6O8S
Molecular Weight648.78
Molecular Weight (Monoisotopic)275.1634
TypeSmall molecule
Max PhasePhase 4
Target IDTar81
Target NameNone
SynonymsESERINE HEMISULFATE SALT|PHYSOSTIGMINE SULFATE|PHYSOSTIGMINE SULFATE (2:1)|PHYSOSTIGMINE SULPHATE|PHYSOSTIGMINE SULPHATE (2:1)
SmilesCNC(=O)Oc1ccc2c(c1)[C@]1(C)CCN(C)[C@@H]1N2C.CNC(=O)Oc1ccc2c(c1)[C@]1(C)CCN(C)[C@@H]1N2C.O=S(=O)(O)O
InchiInChI=1S/2C15H21N3O2.H2O4S/c2*1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2;1-5(2,3)4/h2*5-6,9,13H,7-8H2,1-4H3,(H,16,19);(H2,1,2,3,4)/t2*13-,15+;/m11./s1
Inchi KeyYYBNDIVPHIWTPK-KYJQVDHRSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities3.0
Np Likeness Score1.15
Records Key['PHYSOSTIGMINE SULFATE', 'PHYSOSTIGMINE SULFATE', 'PHYSOSTIGMINE SULFATE', 'Eserine hemisulfate salt']
Records Name['PHYSOSTIGMINE SULFATE', 'PHYSOSTIGMINE SULFATE', 'PHYSOSTIGMINE SULFATE', 'Eserine hemisulfate salt']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure