SMILES:
COC(=O)c1cc2c(N3CCN(CCC(C(=O)N4CCCCCC4)c4ccccc4)CC3)cccc2[nH]1Molecular Processing
Molecular formula
C30H38N4O3
Molecular weight
502.66
Exact mass
502.2944
XLogP
4.65
TPSA
68.88
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
37
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
147.14
Supplementary Information
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