COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL308788
Chemical Name: methyl(2E)-2-{[4-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)butanoyl]imino}-5-(2-methylpropyl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Smiles: COC(=O)c1[nH]/c(=N\C(=O)CCCN2C(=O)c3c(C2=O)nccc3)/sc1CC(C)C

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Molecular Weight: 430.48
Empirical Formula: C20H22N4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.413
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 143
Number of rings: 3

     

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