SMILES:
Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2C1CCC2(CC1)OCCO2Molecular Processing
Molecular formula
C26H26N4O3
Molecular weight
442.52
Exact mass
442.2005
XLogP
5.33
TPSA
84.42
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
33
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
126.03
Supplementary Information
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