COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK992415
Chemical Name: (2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl4-bromobenzenesulfonate
Smiles: Brc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O

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Molecular Weight: 463.33
Empirical Formula: C19H11BrO5S2

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.218
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 106
Number of rings: 4

     

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