SMILES:
COCCCOc1cc(C(=O)N(CC2CN(C(=O)OC(C)(C)C)CC2CNC2CC2)C(C)C)ccc1OCMolecular Processing
Molecular formula
C29H47N3O6
Molecular weight
533.71
Exact mass
533.3465
XLogP
4.2
TPSA
89.57
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
13
Heavy atoms
38
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.724
Molar refractivity
146.97
Supplementary Information
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