COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK088899
Chemical Name: 7-(2-chloro-6-fluorobenzyl)-8-[(2-hydroxy-2-phenylethyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(c1ccccc1)CNc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C

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Molecular Weight: 457.89
Empirical Formula: C22H21ClFN5O3

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 3.323
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 90
Number of rings: 4

     

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