COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK605601
Chemical Name: (4E)-5-(3,4-dimethoxyphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1OC)C1N(c2nc3c(s2)cc(cc3)CC)C(=O)C(=O)/C/1=C(\c1ccc(cc1)F)/O

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Molecular Weight: 518.57
Empirical Formula: C28H23FN2O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.366
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 5

     

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