Cc1ccc(C)n1-c1ccc2sccc2c1
SMILES: Cc1ccc(C)n1-c1ccc2sccc2c1

Molecular Processing

Molecular formula
C14H13NS
Molecular weight
227.33
Exact mass
227.0769
XLogP
4.31
TPSA
4.93
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
16
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
70.63

Supplementary Information

Details werden geladen…

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