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Chem Baclofen 2 | Cheminformatics

Baclofen


  • SKU Code: CH136869
Chemical Name - Baclofen
Mol Weight - 213.663
Smiles - NCC(CC(O)=O)c(cc1)ccc1Cl
Property Name Property Value
Mol NameBaclofen
Molweight213.663
Monoisotopic Mass213.055656
Clogp-0.4206
Clogs-2.537
H Acceptors3
H Donors2
Total Surface Area161.32
Relative Psa0.25669
Polar Surface Area63.32
Druglikeness-0.50092
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.64286
Molecular Flexibility0.60695
Molecular Complexity0.58727
Fragments1
Non H Atoms14
Non Ch Atoms4
Electronegative Atoms4
Stereo Centers1
Rotatable Bonds4
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms5
Symmetric Atoms2
Amines1
Alkyl Amines1
Basic Nitrogens1
Acidic Oxygens1
SmilesNCC(CC(O)=O)c(cc1)ccc1Cl
InChIKey
InChIC10H12NO2Cl

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1 - Baclofen
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