COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL340852
Chemical Name: 7-(2-chloro-5-methoxybenzyl)-8-[(2-hydroxyethyl)(methyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCN(c1nc2c(n1Cc1cc(OC)ccc1Cl)c(=O)n(c(=O)n2C)C)C

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Molecular Weight: 407.86
Empirical Formula: C18H22ClN5O4

Physical State: Dry powder
Available Amount: 216 mg

Lipinsky:
logP: 1.843
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 91
Number of rings: 3

     

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