COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK957098
Chemical Name: 4-(3-{[N'-(1,3-benzodioxol-5-yl)-N-ethylcarbamimidoyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoicacid
Smiles: CCN/C(=N\c1ccc2c(c1)OCO2)/SC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)O

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Molecular Weight: 441.46
Empirical Formula: C21H19N3O6S

Available Amount: 0 mg

Lipinsky:
logP: 2.079
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 142
Number of rings: 4

     

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