SMILES:
COc1cc2nc(N3CCN(c4ccnc(Oc5ccccc5)n4)CC3)nc(N)c2cc1OCMolecular Processing
Molecular formula
C24H25N7O3
Molecular weight
459.51
Exact mass
459.2019
XLogP
3.14
TPSA
111.75
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
6
Heavy atoms
34
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
130.03
Supplementary Information
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