COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK905348
Chemical Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(4-fluorophenyl)-3-hydroxy-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)F)C(=C(C1=O)O)C(=O)c1ccc2c(c1)CC(O2)C

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Saltdata: 1/5CH3COOH
Molecular Weight: 530.58
Empirical Formula: C29H23FN2O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.299
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 6

     

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