SMILES:
CC(C)N1CCC(Oc2ccc3c(c2)cc2n3C(C)CN(Cc3ccncc3)C2=O)CC1Molecular Processing
Molecular formula
C26H32N4O2
Molecular weight
432.57
Exact mass
432.2525
XLogP
4.5
TPSA
50.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
32
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
125.99
Supplementary Information
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