SMILES:
COC(=O)C(CCSC)N(C(=O)OC(C)(C)C)C(=O)c1ccc(N)cc1Molecular Processing
Molecular formula
C18H26N2O5S
Molecular weight
382.48
Exact mass
382.1562
XLogP
2.94
TPSA
98.93
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
26
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
102.06
Supplementary Information
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