SMILES:
Cn1nnc(-c2ccc(Oc3cc4nc(-c5ccccn5)[nH]c4cc3C3CCCN3)cc2)n1Molecular Processing
Molecular formula
C24H22N8O
Molecular weight
438.5
Exact mass
438.1917
XLogP
4.03
TPSA
106.43
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
33
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.208
Molar refractivity
123.61
Supplementary Information
Obteniendo detalles…
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