SMILES:
CC(C)(O)c1ccc2c(c1)C(=CCCN1CCC(OCc3ccc(Cl)cc3)C1)c1cccnc1CO2Molecular Processing
Molecular formula
C30H33ClN2O3
Molecular weight
505.06
Exact mass
504.218
XLogP
5.97
TPSA
54.82
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
36
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.367
Molar refractivity
143.04
Supplementary Information
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