SMILES:
CC(C)(C)CC1NC(C(=O)N2CCC(CC(=O)O)CC2)C(c2cccc(Cl)c2F)C1(C#N)c1ccc(Cl)cc1FMolecular Processing
Molecular formula
C30H33Cl2F2N3O3
Molecular weight
592.51
Exact mass
591.1867
XLogP
6.31
TPSA
93.43
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
40
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
149.19
Supplementary Information
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