COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK557364
Chemical Name: 1,3-dimethyl-7-(4-methylbenzyl)-8-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)Cn1c(N/N=C/c2ccncc2)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 403.44
Empirical Formula: C21H21N7O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.246
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 95
Number of rings: 4

     

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