COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044732
Chemical Name: 4-[(E)-(2-{[4-(4-chlorobenzyl)piperazin-1-ium-1-yl]acetyl}hydrazinylidene)methyl]benzoate
Smiles: O=C(C[NH+]1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/c1ccc(cc1)C(=O)[O-]

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Molecular Weight: 414.89
Empirical Formula: C21H23ClN4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.864
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 89
Number of rings: 3

     

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