SMILES:
COc1cccc2c(Nc3ccc(C(=O)NC4CCN(Cc5ccccc5)CC4)cc3)c(C(=O)O)cnc12Molecular Processing
Molecular formula
C30H30N4O4
Molecular weight
510.59
Exact mass
510.2267
XLogP
5.08
TPSA
103.79
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
38
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.233
Molar refractivity
147.19
Supplementary Information
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