COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056348
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-(3-phenoxyphenyl)pyrrolidine-2,3-dione
Smiles: CC1Cc2c(O1)ccc(c2)/C(=C\1/C(c2cccc(c2)Oc2ccccc2)N(C(=O)C1=O)c1nc2c(s1)cc(cc2C)C)/O

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Molecular Weight: 588.68
Empirical Formula: C35H28N2O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.985
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 7

     

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