COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL074479
Chemical Name: methyl2-({[1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetyl}amino)benzoate
Smiles: COC(=O)c1ccccc1NC(=O)Cn1cnc2c(c1=O)cnn2c1ccc(cc1)F

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Molecular Weight: 421.39
Empirical Formula: C21H16FN5O4

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.212
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 105
Number of rings: 4

     

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