COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK834909
Chemical Name: 8-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(SC/C=C(\Cl)/C)nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1

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Molecular Weight: 436.92
Empirical Formula: C19H21ClN4O4S

Physical State: Dry powder
Available Amount: 293 mg

Lipinsky:
logP: 4.072
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 121
Number of rings: 3

     

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