SMILES:
Cc1sc2nc(-c3ccccc3)nc(N)c2c1CMolecular Processing
Molecular formula
C14H13N3S
Molecular weight
255.35
Exact mass
255.083
XLogP
3.56
TPSA
51.8
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
76.74
Supplementary Information
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