COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK734161
Chemical Name: 1-[(4-benzyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3,3-dimethylbutan-2-one
Smiles: O=C(C(C)(C)C)CSc1nnc(n1Cc1ccccc1)c1ccccc1

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Molecular Weight: 365.5
Empirical Formula: C21H23N3OS

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 5.635
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 73
Number of rings: 3

     

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