SMILES:
OCC1=C(c2ccc3sccc3c2)N2CCN=C2S1Molecular Processing
Molecular formula
C14H12N2OS2
Molecular weight
288.4
Exact mass
288.0391
XLogP
2.98
TPSA
35.83
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
19
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
82.43
Supplementary Information
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