COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL448378
Chemical Name: 3-(2-cyanoethyl)-1-phenyl-4-(phenylcarbamoyl)-1H-1,2,3-triazol-3-ium-5-olate
Smiles: N#CCC[n+]1nn(c(c1C(=O)Nc1ccccc1)[O-])c1ccccc1

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Molecular Weight: 333.35
Empirical Formula: C18H15N5O2

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 0
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 97
Number of rings: 3

     

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