COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047572
Chemical Name: 2-methoxy-4-[(E)-(2-{[4-(4-methylbenzyl)piperazin-1-ium-1-yl]acetyl}hydrazinylidene)methyl]phenolate
Smiles: COc1cc(/C=N/NC(=O)C[NH+]2CCN(CC2)Cc2ccc(cc2)C)ccc1[O-]

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Molecular Weight: 396.49
Empirical Formula: C22H28N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.251
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 81
Number of rings: 3

     

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