clobenpropit

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 38
Total Number of Articles : 42
PubChem 2790
Molecular Formula

C14H17ClN4S

SMILES

C1=CC(=CC=C1CN=C(N)SCCCC2=CN=CN2)Cl

InChI

InChI=1S/C14H17ClN4S/c15-12-5-3-11(4-6-12)8-18-14(16)20-7-1-2-13-9-17-10-19-13/h3-6,9-10H,1-2,7-8H2,(H2,16,18)(H,17,19)

synonyms
  • clobenpropit
  • 145231-45-4
  • Vuf-9153
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Properties
Property Value
MW 308.8 g/mol
HBD 2
HBA 3
Rotatable Bond Count 7
Exact Mass 308.0862454 g/mol
Monoisotopic Mass 308.0862454 g/mol
Heavy Atom Count 20
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 306
xlogp 3
Topological Polar Surface Area 92.4