COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561702
Chemical Name: (4E)-5-(4-bromophenyl)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)Br)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

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Molecular Weight: 555.84
Empirical Formula: C25H16BrClN2O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.841
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 107
Number of rings: 5

     

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