COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK140204
Chemical Name: (2E)-1-[3-(furan-2-yl)-5-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]-3-phenylprop-2-en-1-one
Smiles: CSc1nc(nn1C(=O)/C=C/c1ccccc1)c1ccco1

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Molecular Weight: 311.36
Empirical Formula: C16H13N3O2S

Physical State: Dry powder
Available Amount: 291 mg

Lipinsky:
logP: 4.005
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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