COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL102142
Chemical Name: N'-[(1E)-1-(3-bromo-4-methoxyphenyl)ethylidene]-2-[(4-nitrobenzyl)sulfanyl]acetohydrazide
Smiles: COc1ccc(cc1Br)/C(=N/NC(=O)CSCc1ccc(cc1)[N+](=O)[O-])/C

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Molecular Weight: 452.33
Empirical Formula: C18H18BrN3O4S

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 4.386
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 2

     

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