COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL093859
Chemical Name: ethyl4-({[(3-butyl-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)piperidine-1-carboxylate
Smiles: CCCCn1c(SCC(=O)NC2CCN(CC2)C(=O)OCC)nc2c(c1=O)[nH]c(c2)C

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Molecular Weight: 449.57
Empirical Formula: C21H31N5O4S

Physical State: Dry powder
Available Amount: 62 mg

Lipinsky:
logP: 1.599
Rotatable bonds: 9
H-donors: 2
H-acceptors: 4
PSA: 132
Number of rings: 3

     

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