SMILES:
Nc1nc2cc(Cl)c(Cl)cc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OMolecular Processing
Molecular formula
C12H13Cl2N3O4
Molecular weight
334.16
Exact mass
333.0283
XLogP
0.54
TPSA
113.76
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
77.17
Supplementary Information
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