SMILES:
Nc1nc2nc(SCc3ccccc3)nc(NC(CO)CO)c2s1Molecular Processing
Molecular formula
C15H17N5O2S2
Molecular weight
363.47
Exact mass
363.0824
XLogP
1.73
TPSA
117.18
H-bond donors
4
H-bond acceptors
9
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
9
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
97.21
Supplementary Information
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