COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL348363
Chemical Name: methyl4-[({[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1ncnc2c1cnn2c1ccc(cc1)Cl

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Molecular Weight: 453.91
Empirical Formula: C21H16ClN5O3S

Physical State: Dry powder
Available Amount: 258 mg

Lipinsky:
logP: 4.652
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 124
Number of rings: 4

     

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