COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL111682
Chemical Name: ethyl4-({[6-methyl-3-(2-methylpropyl)-2-(methylsulfanyl)-4-oxo-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl]acetyl}amino)piperidine-1-carboxylate
Smiles: CCOC(=O)N1CCC(CC1)NC(=O)Cn1c(C)cc2c1c(=O)n(c(n2)SC)CC(C)C

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Molecular Weight: 463.6
Empirical Formula: C22H33N5O4S

Physical State: Dry powder
Available Amount: 111 mg

Lipinsky:
logP: 1.655
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 3

     

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