COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK757110
Chemical Name: methyl4-(3-{[N-(1,3-benzodioxol-5-ylmethyl)-N'-phenylcarbamimidoyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)S/C(=N/c1ccccc1)/NCc1ccc2c(c1)OCO2

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Molecular Weight: 517.56
Empirical Formula: C27H23N3O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.076
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 131
Number of rings: 5

     

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