COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL093756
Chemical Name: 2-{[3-(butan-2-yl)-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}-N-ethyl-N-(3-methylphenyl)acetamide
Smiles: CCN(c1cccc(c1)C)C(=O)CSc1nc2cc([nH]c2c(=O)n1C(CC)C)C

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Molecular Weight: 412.56
Empirical Formula: C22H28N4O2S

Physical State: Dry powder
Available Amount: 81 mg

Lipinsky:
logP: 3.894
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 94
Number of rings: 3

     

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