COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK197586
Chemical Name: 5-{2,5-dimethyl-3-[(E)-(4H-1,2,4-triazol-4-ylimino)methyl]-1H-pyrrol-1-yl}benzene-1,3-dicarboxylicacid
Smiles: OC(=O)c1cc(cc(c1)n1c(C)cc(c1C)/C=N/n1cnnc1)C(=O)O

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Molecular Weight: 353.34
Empirical Formula: C17H15N5O4

Physical State: Dry powder
Available Amount: 289 mg

Lipinsky:
logP: 2.45
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 122
Number of rings: 3

     

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