SMILES:
COc1cccc2c1C(NC1=Nc3ccc(NC(=O)CN4CCOCC4)cc3CO1)CC2Molecular Processing
Molecular formula
C24H28N4O4
Molecular weight
436.51
Exact mass
436.2111
XLogP
2.76
TPSA
84.42
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
32
Rings
5
Aromatic rings
2
Saturated rings
1
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
121.41
Supplementary Information
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