COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL178943
Chemical Name: 1-(4-{[4-(3-bromobenzyl)piperazin-1-yl]sulfonyl}phenyl)pyrrolidin-2-one
Smiles: Brc1cccc(c1)CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)N1CCCC1=O

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Molecular Weight: 478.41
Empirical Formula: C21H24BrN3O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.018
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 69
Number of rings: 4

     

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