Nombre: Zincate
SMILES:
CN(C)CC#Cc1cnccc1OCc1nnc2ccc(-c3ccccc3)nn12Molecular Processing
Molecular formula
C22H20N6O
Molecular weight
384.44
Exact mass
384.1699
XLogP
2.68
TPSA
68.44
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
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
0.182
Molar refractivity
110.22
Supplementary Information
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