COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL396234
Chemical Name: ethyl4-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]methyl}-2-(prop-2-en-1-ylamino)-1,3-thiazole-5-carboxylate
Smiles: C=CCNc1sc(c(n1)Cn1cnc2c(c1=O)cnn2c1ccc(cc1)F)C(=O)OCC

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Molecular Weight: 454.48
Empirical Formula: C21H19FN6O3S

Physical State: Dry powder
Available Amount: 41 mg

Lipinsky:
logP: 2.11
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 129
Number of rings: 4

     

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