COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL017270
Chemical Name: 4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-2-methoxyphenyl4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(=O)c1csc2c1CCCC2)/c1nc2c(s1)cccc2

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Molecular Weight: 472.59
Empirical Formula: C26H20N2O3S2

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 7.513
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 128
Number of rings: 5

     

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