COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL442178
Chemical Name: 1-amino-3-[2-(4-chlorophenyl)-2-oxoethyl]-4-(ethoxycarbonyl)-1H-1,2,3-triazol-3-ium-5-olate
Smiles: CCOC(=O)c1[n+](CC(=O)c2ccc(cc2)Cl)nn(c1[O-])N

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Molecular Weight: 324.72
Empirical Formula: C13H13ClN4O4

Physical State: Dry powder
Available Amount: 22 mg

Lipinsky:
logP: 0
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 114
Number of rings: 2

     

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