COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL439637
Chemical Name: 3-[2-(4-chlorophenyl)-2-oxoethyl]-4-(methylcarbamoyl)-1-{[(E)-phenylmethylidene]amino}-1H-1,2,3-triazol-3-ium-5-olate
Smiles: CNC(=O)c1[n+](nn(c1[O-])/N=C/c1ccccc1)CC(=O)c1ccc(cc1)Cl

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Molecular Weight: 397.82
Empirical Formula: C19H16ClN5O3

Physical State: Dry powder
Available Amount: 212 mg

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

     

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