COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK642648
Chemical Name: (4aR,7aS)-1-(3-chlorophenyl)-4-[2-(2,5-dimethoxyphenyl)ethyl]hexahydrothieno[3,4-b]pyrazin-2(1H)-one6,6-dioxide
Smiles: COc1ccc(c(c1)CCN1CC(=O)N([C@H]2[C@@H]1CS(=O)(=O)C2)c1cccc(c1)Cl)OC

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Molecular Weight: 464.97
Empirical Formula: C22H25ClN2O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.099
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 84
Number of rings: 4

     

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