COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK599699
Chemical Name: (8Z)-8-[(2E)-(1,3-benzodioxol-5-ylmethylidene)hydrazinylidene]-1,3,7-trimethyl-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: Cn1/c(=N\N=C\c2ccc3c(c2)OCO3)/[nH]c2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 356.34
Empirical Formula: C16H16N6O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.584
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 4

     

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