COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK582591
Chemical Name: (4E)-5-[4-(benzyloxy)phenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: Cc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccc(cc1)OCc1ccccc1

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Molecular Weight: 541.58
Empirical Formula: C29H23N3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.903
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 139
Number of rings: 6

     

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