COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL201038
Chemical Name: 3-hydroxy-1-(6-methoxy-1,3-benzothiazol-2-yl)-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc2c(c1)sc(n2)N1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccc2c(c1)CC(O2)C

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Saltdata: 1/4CH3COOH
Molecular Weight: 543.56
Empirical Formula: C28H21N3O7S

Available Amount: 0 mg

Lipinsky:
logP: 5.446
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 163
Number of rings: 6

     

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