SMILES:
CCc1cn([C@H]2C[C@H](O)[C@@H](CNC(=O)c3ccccc3)O2)c(=O)[nH]c1=OMolecular Processing
Molecular formula
C18H21N3O5
Molecular weight
359.38
Exact mass
359.1481
XLogP
0.18
TPSA
113.42
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.389
Molar refractivity
94.01
Supplementary Information
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