SMILES:
COC(=O)C1Cc2cc3c(cc2CN1C(=O)OC(C)C)O[C@@H](c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)C(=O)N3Molecular Processing
Molecular formula
C30H28Cl2N2O7
Molecular weight
599.47
Exact mass
598.1274
XLogP
6.09
TPSA
103.4
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
41
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
152.34
Supplementary Information
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