COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL105757
Chemical Name: 8-[(2,4-dimethylphenyl)sulfanyl]-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)Cn1nc2n(c1=O)ccnc2Sc1ccc(cc1C)C

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Molecular Weight: 492.58
Empirical Formula: C25H25FN6O2S

Physical State: Dry powder
Available Amount: 87 mg

Lipinsky:
logP: 2.756
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 97
Number of rings: 5

     

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