SMILES:
NCCc1ccccc1Sc1c[nH]c2ccccc12Molecular Processing
Molecular formula
C16H16N2S
Molecular weight
268.38
Exact mass
268.1034
XLogP
3.82
TPSA
41.81
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
19
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
81.62
Supplementary Information
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