ML141

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 24
Total Number of Articles : 17
PubChem 2950007
Molecular Formula

C22H21N3O3S

SMILES

COC1=CC=C(C=C1)C2CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3S/c1-28-19-11-7-17(8-12-19)22-15-21(16-5-3-2-4-6-16)24-25(22)18-9-13-20(14-10-18)29(23,26)27/h2-14,22H,15H2,1H3,(H2,23,26,27)

synonyms
  • 71203-35-5
  • ML141
  • ML 141
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Properties
Property Value
MW 407.5 g/mol
HBD 1
HBA 6
Rotatable Bond Count 5
Exact Mass 407.13036271 g/mol
Monoisotopic Mass 407.13036271 g/mol
Heavy Atom Count 29
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 668
xlogp 3.6
Topological Polar Surface Area 93.4