COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK570435
Chemical Name: (4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)Cl

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Molecular Weight: 563.03
Empirical Formula: C29H23ClN2O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.958
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 126
Number of rings: 6

     

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