이름: 4-(diethylamino)benzothioamide
SMILES:
CCN(CC)c1ccc(C(N)=S)cc1Molecular Processing
Molecular formula
C11H16N2S
Molecular weight
208.33
Exact mass
208.1034
XLogP
2.17
TPSA
29.26
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
65.89
Supplementary Information
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