SMILES:
N#Cc1nccnc1-c1ccc(O)cc1Molecular Processing
Molecular formula
C11H7N3O
Molecular weight
197.2
Exact mass
197.0589
XLogP
1.72
TPSA
69.8
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
53.85
Supplementary Information
Récupération des détails…
Impliqué dans 4 réactions→