SMILES:
O=C(O)C1CC2(CN1)SCCS2Molecular Processing
Molecular formula
C7H11NO2S2
Molecular weight
205.3
Exact mass
205.0231
XLogP
0.61
TPSA
49.33
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
12
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.857
Molar refractivity
51.69
Supplementary Information
상세 정보 불러오는 중…
4개 반응에 참여→