COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK907451
Chemical Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-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(c(c2)OC)O)C(=C(C1=O)O)C(=O)c1ccc2c(c1)CC(O2)C

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Saltdata: 1/5CH3COOH
Molecular Weight: 558.61
Empirical Formula: C30H26N2O7S

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 5.216
Rotatable bonds: 8
H-donors: 2
H-acceptors: 7
PSA: 146
Number of rings: 6

     

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