COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL442161
Chemical Name: 4-(benzylcarbamoyl)-3-[2-(4-chlorophenyl)-2-oxoethyl]-1-{[(E)-(4-methylphenyl)methylidene]amino}-1H-1,2,3-triazol-3-ium-5-olate
Smiles: Cc1ccc(cc1)/C=N/n1n[n+](c(c1[O-])C(=O)NCc1ccccc1)CC(=O)c1ccc(cc1)Cl

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Molecular Weight: 487.95
Empirical Formula: C26H22ClN5O3

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 0
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 103
Number of rings: 4

     

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