SMILES:
S=c1[nH]c2ncccc2o1Molecular Processing
Molecular formula
C6H4N2OS
Molecular weight
152.18
Exact mass
152.0044
XLogP
1.89
TPSA
41.82
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
10
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
39.19
Supplementary Information
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