CC1=CC(N2CCC3(CC2)OCCO3)C(O)C(C)(C)CC1=O
SMILES: CC1=CC(N2CCC3(CC2)OCCO3)C(O)C(C)(C)CC1=O

Molecular Processing

Molecular formula
C17H27NO4
Molecular weight
309.41
Exact mass
309.194
XLogP
1.5
TPSA
59
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
22
Rings
3
Aromatic rings
0
Saturated rings
2
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.824
Molar refractivity
82.4

Supplementary Information

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