SMILES:
Cc1cc(CC#N)ccc1Sc1ccccc1Molecular Processing
Molecular formula
C15H13NS
Molecular weight
239.34
Exact mass
239.0769
XLogP
4.21
TPSA
23.79
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
71.06
Supplementary Information
Details werden geladen…
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