이름: 4',6-dichlorothioflavanone
SMILES:
S=C1CC(c2ccc(Cl)cc2)Oc2ccc(Cl)cc21Molecular Processing
Molecular formula
C15H10Cl2OS
Molecular weight
309.22
Exact mass
307.9829
XLogP
5.24
TPSA
9.23
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
82.59
Supplementary Information
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