COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL111609
Chemical Name: methyl2-({[6-methyl-3-(2-methylpropyl)-2-(methylsulfanyl)-4-oxo-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl]acetyl}amino)benzoate
Smiles: COC(=O)c1ccccc1NC(=O)Cn1c(C)cc2c1c(=O)n(c(n2)SC)CC(C)C

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Molecular Weight: 442.54
Empirical Formula: C22H26N4O4S

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 3.723
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 118
Number of rings: 3

     

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