COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK262536
Chemical Name: 8-[(1,3-benzodioxol-5-ylmethyl)amino]-1,3-dimethyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)Cn1c(NCc2ccc3c(c2)OCO3)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 433.47
Empirical Formula: C23H23N5O4

Physical State: Dry powder
Available Amount: 191 mg

Lipinsky:
logP: 4.004
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 88
Number of rings: 5

     

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