COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK035184
Chemical Name: 1-(2-chloro-6-fluorobenzyl)-3,7-dimethyl-8-[(pyridin-2-ylmethyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1cccc(c1Cn1c(=O)c2n(C)c(nc2n(c1=O)C)NCc1ccccn1)Cl

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Molecular Weight: 428.85
Empirical Formula: C20H18ClFN6O2

Physical State: Dry powder
Available Amount: 118 mg

Lipinsky:
logP: 2.396
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 83
Number of rings: 4

     

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