MKT 077

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 19
Total Number of Articles : 19
PubChem 6918334
Molecular Formula

C21H22ClN3OS2

SMILES

CCN1/C(=C\C2=CC=CC=[N+]2CC)/S/C(=C/3\N(C4=CC=CC=C4S3)C)/C1=O.[Cl-]

InChI

InChI=1S/C21H22N3OS2.ClH/c1-4-23-13-9-8-10-15(23)14-18-24(5-2)20(25)19(27-18)21-22(3)16-11-6-7-12-17(16)26-21;/h6-14H,4-5H2,1-3H3;1H/q+1;/p-1/b21-19+;

synonyms
  • Mkt 077
  • SDZ-MKT-077
  • AKOS024458258
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Properties
Property Value
MW 432.0 g/mol
HBD 0
HBA 5
Rotatable Bond Count 3
Exact Mass 431.0892824 g/mol
Monoisotopic Mass 431.0892824 g/mol
Heavy Atom Count 28
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 2
Complexity 647
xlogp None
Topological Polar Surface Area 78