COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL322959
Chemical Name: 1-(4-chlorobenzyl)-8-[(2-hydroxy-2-phenylethyl)amino]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)NCC(c1ccccc1)O

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Molecular Weight: 439.9
Empirical Formula: C22H22ClN5O3

Available Amount: 0 mg

Lipinsky:
logP: 3.712
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 90
Number of rings: 4

     

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