COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL005150
Chemical Name: methyl3-{[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl}thiophene-2-carboxylate
Smiles: COC(=O)c1sccc1S(=O)(=O)N1CCN(CC1)c1cc(C)ccc1C

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Molecular Weight: 394.52
Empirical Formula: C18H22N2O4S2

Available Amount: 0 mg

Lipinsky:
logP: 3.216
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 103
Number of rings: 3

     

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