SMILES:
Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2C1CCCC1OMolecular Processing
Molecular formula
C23H22N4O2
Molecular weight
386.46
Exact mass
386.1743
XLogP
4.56
TPSA
86.19
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
29
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.217
Molar refractivity
112.79
Supplementary Information
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