SMILES:
COc1cc2ncc(C#N)c(Nc3cccc4cccnc34)c2cc1OCMolecular Processing
Molecular formula
C21H16N4O2
Molecular weight
356.39
Exact mass
356.1273
XLogP
4.42
TPSA
80.06
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
27
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.095
Molar refractivity
104.59
Supplementary Information
No supplementary data available
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