COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL135167
Chemical Name: 2-{[6-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-3-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl}-N-(butan-2-yl)acetamide
Smiles: CCC(NC(=O)CSc1nc2c(C)nn(c2c(=O)n1Cc1ccc2c(c1)OCO2)CC)C

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Molecular Weight: 457.55
Empirical Formula: C22H27N5O4S

Available Amount: 0 mg

Lipinsky:
logP: 2.369
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 123
Number of rings: 4

     

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