Name: meclocycline sulfosalicylate
SMILES:
C=C1c2c(Cl)ccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@@H]3[C@@H](O)[C@H]12.O=C(O)c1cc(S(=O)(=O)O)ccc1OMolecular Processing
Molecular formula
C29H27ClN2O14S
Molecular weight
695.06
Exact mass
694.0872
XLogP
0.55
TPSA
293.52
H-bond donors
9
H-bond acceptors
13
Rotatable bonds
4
Heavy atoms
47
Rings
5
Aromatic rings
2
Saturated rings
0
Aliphatic rings
3
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
18
Covalent units
2
Fraction Csp3
0.241
Molar refractivity
160.28
Supplementary Information
Details werden geladen…
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