COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562579
Chemical Name: (4E)-5-(3-bromophenyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: Brc1cccc(c1)C1N(c2sc3c(n2)c(C)cc(c3)C)C(=O)C(=O)/C/1=C(\c1ccccc1)/O

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Molecular Weight: 519.42
Empirical Formula: C26H19BrN2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.321
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 98
Number of rings: 5

     

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