SMILES:
CCN(CC)C/C=C/c1cnc(N)c2c(-c3ccc(Oc4ccccc4)cc3)noc12Molecular Processing
Molecular formula
C25H26N4O2
Molecular weight
414.51
Exact mass
414.2056
XLogP
5.62
TPSA
77.41
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
31
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
124.99
Supplementary Information
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