SMILES:
CONC(=O)c1ccccc1Nc1ccc2c(C=Cc3ccccn3)n[nH]c2c1Molecular Processing
Molecular formula
C22H19N5O2
Molecular weight
385.43
Exact mass
385.1539
XLogP
4.16
TPSA
91.93
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
29
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.045
Molar refractivity
113.46
Supplementary Information
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