COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807529
Chemical Name: 3-(3-chloro-1-benzothiophen-2-yl)-4-(4-methoxyphenyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1c1sc2c(c1Cl)cccc2

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Molecular Weight: 490.05
Empirical Formula: C26H20ClN3OS2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 9.61
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 93
Number of rings: 5

     

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