COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK833838
Chemical Name: 7-[(2E)-but-2-en-1-yl]-8-{(2E)-2-[1-(4-hydroxyphenyl)ethylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C=C/Cn1c(N/N=C(/c2ccc(cc2)O)\C)nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 368.4
Empirical Formula: C18H20N6O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.363
Rotatable bonds: 4
H-donors: 3
H-acceptors: 3
PSA: 111
Number of rings: 3

     

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