SMILES:
Cc1cc(OC2CN(C(=O)c3nnc(-c4ccccc4)o3)C2)ccc1CN1CC2(CCCO2)C1Molecular Processing
Molecular formula
C26H28N4O4
Molecular weight
460.53
Exact mass
460.2111
XLogP
3.31
TPSA
80.93
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
34
Rings
6
Aromatic rings
3
Saturated rings
3
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.423
Molar refractivity
124.43
Supplementary Information
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