이름: amine
SMILES:
Cl.NCCSCc1ccsn1Molecular Processing
Molecular formula
C6H11ClN2S2
Molecular weight
210.76
Exact mass
210.0052
XLogP
1.76
TPSA
38.91
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
2
Fraction Csp3
0.5
Molar refractivity
54.58
Supplementary Information
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