Granisetron

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 53
Total Number of Articles : 93
PubChem 86287410
Molecular Formula

C18H24N4O

SMILES

[2H]C([2H])([2H])N1C2=CC=CC=C2C(=N1)C(=O)NC3C[C@H]4CCC[C@@H](C3)N4C

InChI

InChI=1S/C18H24N4O/c1-21-13-6-5-7-14(21)11-12(10-13)19-18(23)17-15-8-3-4-9-16(15)22(2)20-17/h3-4,8-9,12-14H,5-7,10-11H2,1-2H3,(H,19,23)/t12?,13-,14+/i2D3

synonyms
  • granisetron
  • Granisetron-d3
  • 1224925-76-1
Click to show/hide the synonyms
Properties
Property Value
MW 315.4 g/mol
HBD 1
HBA 3
Rotatable Bond Count 2
Exact Mass 315.21384164 g/mol
Monoisotopic Mass 315.21384164 g/mol
Heavy Atom Count 23
Isotope Atom Count 3
Atom Stereo Count 2
Covalent Unit Count 1
Complexity 442
xlogp 2.8
Topological Polar Surface Area 50.2