COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK697896
Chemical Name: 1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-[(2-phenylethyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1Cl)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)NCCc1ccccc1

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Molecular Weight: 458.35
Empirical Formula: C22H21Cl2N5O2

Physical State: Dry powder
Available Amount: 25 mg

Lipinsky:
logP: 5.163
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 70
Number of rings: 4

     

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