SMILES:
NCc1nnc(-c2ncn3c2C2CCN2C(=O)c2sccc2-3)o1Molecular Processing
Molecular formula
C14H12N6O2S
Molecular weight
328.36
Exact mass
328.0742
XLogP
1.34
TPSA
103.07
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
2
Heavy atoms
23
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
81.02
Supplementary Information
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