COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK907301
Chemical Name: 3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1O)C1N(c2nc3c(s2)cc(cc3)OC)C(=O)C(=C1C(=O)c1ccc2c(c1)CC(O2)C)O

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Saltdata: 1/3CH3COOH
Molecular Weight: 544.58
Empirical Formula: C29H24N2O7S

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 4.684
Rotatable bonds: 7
H-donors: 2
H-acceptors: 7
PSA: 146
Number of rings: 6

     

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