SMILES:
CN(C)Cc1ccc(CSCCNc2nc(N)n[nH]2)o1Molecular Processing
Molecular formula
C12H20N6OS
Molecular weight
296.4
Exact mass
296.1419
XLogP
1.39
TPSA
96
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
81.55
Supplementary Information
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