COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL442172
Chemical Name: 3-benzyl-1-{[(E)-(4-chlorophenyl)methylidene]amino}-4-(ethoxycarbonyl)-1H-1,2,3-triazol-3-ium-5-olate
Smiles: CCOC(=O)c1[n+](Cc2ccccc2)nn(c1[O-])/N=C/c1ccc(cc1)Cl

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Molecular Weight: 384.82
Empirical Formula: C19H17ClN4O3

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 0
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 83
Number of rings: 3

     

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