COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK195680
Chemical Name: 3-{2,5-dimethyl-3-[(E)-(4H-1,2,4-triazol-4-ylimino)methyl]-1H-pyrrol-1-yl}benzoicacid
Smiles: OC(=O)c1cccc(c1)n1c(C)cc(c1C)/C=N/n1cnnc1

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Molecular Weight: 309.33
Empirical Formula: C16H15N5O2

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.685
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 85
Number of rings: 3

     

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