COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038175
Chemical Name: 4-[(E)-(2-{[4-(2-chlorobenzyl)piperazin-1-ium-1-yl]acetyl}hydrazinylidene)methyl]-2-methoxyphenolate
Smiles: COc1cc(/C=N/NC(=O)C[NH+]2CCN(CC2)Cc2ccccc2Cl)ccc1[O-]

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Molecular Weight: 416.91
Empirical Formula: C21H25ClN4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.386
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 81
Number of rings: 3

     

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