SMILES:
N[C@@H]1CCC[C@@H](O)c2sccc21Molecular Processing
Molecular formula
C9H13NOS
Molecular weight
183.28
Exact mass
183.0718
XLogP
1.97
TPSA
46.25
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
50.06
Supplementary Information
상세 정보 불러오는 중…
1개 반응에 참여→