COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK734469
Chemical Name: 3,3-dimethyl-1-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}butan-2-one
Smiles: O=C(C(C)(C)C)CSc1nnc(n1c1ccccc1)c1cccs1

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Molecular Weight: 357.5
Empirical Formula: C18H19N3OS2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.651
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 101
Number of rings: 3

     

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