COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK760139
Chemical Name: methyl4-(3-{[N'-(1,3-benzodioxol-5-yl)-N-ethylcarbamimidoyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoate
Smiles: CCN/C(=N\c1ccc2c(c1)OCO2)/SC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)OC

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Molecular Weight: 455.49
Empirical Formula: C22H21N3O6S

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 2.381
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 131
Number of rings: 4

     

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