SMILES:
COc1ccc2ccc(=O)n(CCCC3(C(=O)O)CCN(C/C=C/c4ccccc4)CC3)c2c1Molecular Processing
Molecular formula
C28H32N2O4
Molecular weight
460.57
Exact mass
460.2362
XLogP
4.67
TPSA
71.77
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
9
Heavy atoms
34
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
135.21
Supplementary Information
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