Cc1nc(CSc2nc(NC(CO)CO)c3sc(N)nc3n2)cs1
SMILES: Cc1nc(CSc2nc(NC(CO)CO)c3sc(N)nc3n2)cs1

Molecular Processing

Molecular formula
C13H16N6O2S3
Molecular weight
384.51
Exact mass
384.0497
XLogP
1.49
TPSA
130.07
H-bond donors
4
H-bond acceptors
11
Rotatable bonds
7
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
97.62

Supplementary Information

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