COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK823026
Chemical Name: (2E)-2-(1,3-benzothiazol-2-yl)-3-(2,3-dimethoxyphenyl)-1-(4-ethoxyphenyl)prop-2-en-1-one
Smiles: CCOc1ccc(cc1)C(=O)/C(=C\c1cccc(c1OC)OC)/c1nc2c(s1)cccc2

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Molecular Weight: 445.54
Empirical Formula: C26H23NO4S

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 7.066
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 85
Number of rings: 4

     

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