COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK818642
Chemical Name: methyl2-{2-(4-chlorophenyl)-4-hydroxy-5-oxo-3-[(2E)-3-phenylprop-2-enoyl]-2,5-dihydro-1H-pyrrol-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COC(=O)c1sc(nc1C)N1C(c2ccc(cc2)Cl)C(=C(C1=O)O)C(=O)/C=C/c1ccccc1

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Molecular Weight: 494.96
Empirical Formula: C25H19ClN2O5S

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 5.376
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 125
Number of rings: 4

     

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