COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK964984
Chemical Name: methyl4-[(2Z)-3-hydroxy-4-methoxy-4-oxobut-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Smiles: COC(=O)/C(=C/C(=O)c1c(C)[nH]c(c1C)C(=O)OC)/O

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Molecular Weight: 281.27
Empirical Formula: C13H15NO6

Available Amount: 0 mg

Lipinsky:
logP: 1.258
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 105
Number of rings: 1

     

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