CCOC(=O)c1sc(N2C[C@H](NC(=O)OC(C)(C)C)[C@@H]2CC)nc1C
SMILES: CCOC(=O)c1sc(N2C[C@H](NC(=O)OC(C)(C)C)[C@@H]2CC)nc1C

Molecular Processing

Molecular formula
C17H27N3O4S
Molecular weight
369.49
Exact mass
369.1722
XLogP
3.12
TPSA
80.76
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
25
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.706
Molar refractivity
97.39

Supplementary Information

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