SMILES:
CC(=O)Nc1cc(Nc2cc(Nc3cn(C)cn3)n3ncc(C#N)c3n2)ccc1CMolecular Processing
Molecular formula
C20H19N9O
Molecular weight
401.43
Exact mass
401.1713
XLogP
3.09
TPSA
124.96
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
30
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.15
Molar refractivity
112.96
Supplementary Information
Загрузка подробностей…
Участвует в 2 реакциях→