SMILES:
COc1ccc(N(CC2CC2)C(N)=S)cc1Molecular Processing
Molecular formula
C12H16N2OS
Molecular weight
236.34
Exact mass
236.0983
XLogP
2.16
TPSA
38.49
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
69.85
Supplementary Information
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