COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK591621
Chemical Name: 7-(2,3-dihydroxypropyl)-8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCC(Cn1c(CN2CCN(CC2)c2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)C)O

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Molecular Weight: 446.48
Empirical Formula: C21H27FN6O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.144
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 105
Number of rings: 4

     

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