SMILES:
Cc1ccc(C(=O)Nc2c(NC(=O)CN3CCC4(CC3)OCCO4)ccc3c2C(=O)c2ccccc2C3=O)cc1Molecular Processing
Molecular formula
C31H29N3O6
Molecular weight
539.59
Exact mass
539.2056
XLogP
3.8
TPSA
114.04
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
40
Rings
6
Aromatic rings
3
Saturated rings
2
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.29
Molar refractivity
147.82
Supplementary Information
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