COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK585437
Chemical Name: (2E)-N-[(2E)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]-3-(4-propoxyphenyl)prop-2-enamide
Smiles: CCCOc1ccc(cc1)/C=C/C(=O)/N=c\1/sc2c([nH]1)ccc(c2)S(=O)(=O)C

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Molecular Weight: 416.52
Empirical Formula: C20H20N2O4S2

Physical State: Dry powder
Available Amount: 203 mg

Lipinsky:
logP: 4.002
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 118
Number of rings: 3

     

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