COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK912231
Chemical Name: methyl2-[3-hydroxy-4-({4-[(3-methylbenzyl)oxy]phenyl}carbonyl)-2-oxo-5-(thiophen-2-yl)-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COC(=O)c1sc(nc1C)N1C(c2cccs2)C(=C(C1=O)O)C(=O)c1ccc(cc1)OCc1cccc(c1)C

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Saltdata: 1/5CH3COOH
Molecular Weight: 560.65
Empirical Formula: C29H24N2O6S2

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 5.882
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 162
Number of rings: 5

     

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