COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK514623
Chemical Name: ethyl2-[3-{[4-(benzyloxy)-3-methylphenyl]carbonyl}-4-hydroxy-5-oxo-2-(3-phenoxyphenyl)-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)N1C(=O)C(=C(C1c1cccc(c1)Oc1ccccc1)C(=O)c1ccc(c(c1)C)OCc1ccccc1)O

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Saltdata: 1/5CH3COOH
Molecular Weight: 660.75
Empirical Formula: C38H32N2O7S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 8.727
Rotatable bonds: 10
H-donors: 1
H-acceptors: 7
PSA: 143
Number of rings: 6

     

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