COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL019521
Chemical Name: 6-[(E)-2-(4-methoxyphenyl)ethenyl]-3-(2-phenylethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: COc1ccc(cc1)/C=C/c1sc2n(n1)c(nn2)CCc1ccccc1

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Saltdata: 2HCl
Molecular Weight: 362.46
Empirical Formula: C20H18N4OS

Physical State: Dry powder
Available Amount: 27 mg

Lipinsky:
logP: 5.393
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 80
Number of rings: 4

     

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