Metabolite DACH platinum methionine

Name
DACH platinum methionine
Description
Not Available
Structure
Synonyms
Not Available
UNII
Not Available
CAS number
Not Available
Weight
Average: 577.62
Monoisotopic: 577.13564
Chemical Formula
C14H30N4O4PtS2
InChI Key
GLZOMFDXFLRMHZ-SKSSAGQDSA-L
InChI
InChI=1S/C6H14N2.2C4H9NO2S.Pt/c7-5-3-1-2-4-6(5)8;2*5-3(1-2-8)4(6)7;/h5-6H,1-4,7-8H2;2*3,8H,1-2,5H2,(H,6,7);/q;;;+2/p-2/t5-,6-;;;/m1.../s1
IUPAC Name
4-{[(3aR,7aR)-2-[(3-amino-3-carboxypropyl)sulfanyl]-octahydrocyclohexa[d]1,3-diaza-2-platinacyclopentan-2-yl]sulfanyl}-2-aminobutanoic acid
SMILES
[H][N]1([H])[C@@H]2CCCC[C@H]2[N]([H])([H])[Pt]1(SCCC(N)C(O)=O)SCCC(N)C(O)=O
Reactions
Spectra
Not Available
Chromatographic Properties
Collision Cross Sections (CCS)
Not Available
Not Available
Predicted Properties
PropertyValueSource
Physiological Charge0Chemaxon
Hydrogen Acceptor Count0Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area159.86 Å2Chemaxon
Rotatable Bond Count10Chemaxon
Refractivity119.32 m3·mol-1Chemaxon
Polarizability42.58 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability0Chemaxon
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon