COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK197362
Chemical Name: methyl4-{2,5-dimethyl-3-[(E)-(4H-1,2,4-triazol-4-ylimino)methyl]-1H-pyrrol-1-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=N/n1cnnc1

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Molecular Weight: 323.35
Empirical Formula: C17H17N5O2

Physical State: Dry powder
Available Amount: 448 mg

Lipinsky:
logP: 2.986
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 74
Number of rings: 3

     

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