rsl

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 34
Total Number of Articles : 29
PubChem 169408377
Molecular Formula

C18H15ClN2O4S

SMILES

CS(=O)(=O)OC1=CC2=CN=CC(=C2C=C1)NC(=O)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H15ClN2O4S/c1-26(23,24)25-15-5-6-16-13(9-15)10-20-11-17(16)21-18(22)8-12-3-2-4-14(19)7-12/h2-7,9-11H,8H2,1H3,(H,21,22)

synonyms
  • 4-[2-(3-chlorophenyl)acetamido]isoquinolin-7-yl methanesulfonate
  • PET-UNK-7fb4f80a-1
  • BDBM627896
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Properties
Property Value
MW 390.8 g/mol
HBD 1
HBA 5
Rotatable Bond Count 5
Exact Mass 390.0441058 g/mol
Monoisotopic Mass 390.0441058 g/mol
Heavy Atom Count 26
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 595
xlogp 3
Topological Polar Surface Area 93.7