COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171281
Chemical Name: 1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-ylN'-1,3-benzodioxol-5-yl-N-ethylcarbamimidothioate
Smiles: CCN/C(=N\c1ccc2c(c1)OCO2)/SC1CC(=O)N(C1=O)c1ccc(cc1)Br

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Molecular Weight: 476.35
Empirical Formula: C20H18BrN3O4S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.175
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 105
Number of rings: 4

     

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