COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK774582
Chemical Name: 4-amino-1-{[(2E)-3-chlorobut-2-en-1-yl]sulfanyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Smiles: C/C(=C\CSc1nnc2n1c1ccccc1c(=O)n2N)/Cl

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Molecular Weight: 321.79
Empirical Formula: C13H12ClN5OS

Physical State: Dry powder
Available Amount: 67 mg

Lipinsky:
logP: 3.871
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 102
Number of rings: 3

     

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