COc1ccc(N2CCOCC2)c2sc(NC(=O)c3ccnc(C)c3)nc12
SMILES: COc1ccc(N2CCOCC2)c2sc(NC(=O)c3ccnc(C)c3)nc12

Molecular Processing

Molecular formula
C19H20N4O3S
Molecular weight
384.46
Exact mass
384.1256
XLogP
3.1
TPSA
76.58
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
27
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
106.13

Supplementary Information

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