COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047536
Chemical Name: (4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(3-fluorophenyl)-4-[hydroxy(4-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)F)c1sc2c(n1)c(C)cc(c2)C)/O

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Molecular Weight: 488.54
Empirical Formula: C27H21FN2O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.546
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 107
Number of rings: 5

     

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