COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK645277
Chemical Name: (3S,4R)-N-[2-(2,5-dimethoxyphenyl)ethyl]-4-[(4-ethylphenyl)sulfonyl]tetrahydrothiophen-3-amine1,1-dioxide
Smiles: COc1ccc(cc1CCN[C@H]1CS(=O)(=O)C[C@@H]1S(=O)(=O)c1ccc(cc1)CC)OC

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Molecular Weight: 467.61
Empirical Formula: C22H29NO6S2

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 2.385
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 115
Number of rings: 3

     

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