COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL039884
Chemical Name: 2-[5-(4-chlorophenyl)-7-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-1H-isoindole-1,3(2H)-dione
Smiles: Clc1ccc(cc1)C1=CC(c2ccccc2)n2c(=N1)[nH]c(n2)N1C(=O)c2c(C1=O)cccc2

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Molecular Weight: 453.89
Empirical Formula: C25H16ClN5O2

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 4.039
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 77
Number of rings: 6

     

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