SMILES:
CC(C)(C)c1cccc(NC(=O)c2ccc(C3CCN(c4ccc(C(=O)O)c(Cl)c4)CC3)cc2)c1Molecular Processing
Molecular formula
C29H31ClN2O3
Molecular weight
491.03
Exact mass
490.2023
XLogP
6.97
TPSA
69.64
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
35
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
0.31
Molar refractivity
142.14
Supplementary Information
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