COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051014
Chemical Name: (4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(4-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)c1sc2c(n1)c(C)cc(c2)C)/O

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Molecular Weight: 512.59
Empirical Formula: C29H24N2O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.257
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 128
Number of rings: 6

     

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