COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL507459
Chemical Name: 5-{(E)-2-[4-(benzyloxy)-3-methoxyphenyl]ethenyl}-6-nitro[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Smiles: COc1cc(ccc1OCc1ccccc1)/C=C/c1[nH]c2ncnn2c(=O)c1[N+](=O)[O-]

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Molecular Weight: 419.4
Empirical Formula: C21H17N5O5

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 2.37
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 124
Number of rings: 4

     

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