Keyword(s): Human Neurotoxin
Molecule Category Free-form
UNII SFK1SGY8V1
EPA CompTox DTXSID50897225

Structure

InChI Key VPOCYEOOFRNHNL-RQDPQJJXSA-J
Smiles [H][N]1([H])[C@@H]2CCCC[C@H]2[N]([H])([H])[Pt]1(Cl)(Cl)(Cl)Cl
InChI
InChI=1S/C6H14N2.4ClH.Pt/c7-5-3-1-2-4-6(5)8;;;;;/h5-6H,1-4,7-8H2;4*1H;/q;;;;;+4/p-4/t5-,6-;;;;;/m1...../s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H14Cl4N2Pt
Molecular Weight 448.96
AlogP -11.77
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Polar Surface Area 52.04
Heavy Atoms 13.0

Cross References

Resources Reference
CAS NUMBER 62816-98-2
NORMAN SUSDAT
FDA SRS SFK1SGY8V1