SMILES:
CCOc1ccc(C#Cc2cnc3c(N)nc4cc(C)ccc4c3c2)cc1Molecular Processing
Molecular formula
C23H19N3O
Molecular weight
353.43
Exact mass
353.1528
XLogP
4.47
TPSA
61.03
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
27
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.13
Molar refractivity
109.78
Supplementary Information
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