COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038079
Chemical Name: {2-[(E)-(2-{[4-(4-chlorobenzyl)piperazin-1-ium-1-yl]acetyl}hydrazinylidene)methyl]phenoxy}acetate
Smiles: [O-]C(=O)COc1ccccc1/C=N/NC(=O)C[NH+]1CCN(CC1)Cc1ccc(cc1)Cl

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Molecular Weight: 444.92
Empirical Formula: C22H25ClN4O4

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 2.69
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 98
Number of rings: 3

     

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