COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK693186
Chemical Name: N'-{(E)-[6-(2-chloropropyl)-4,7-dimethoxy-1,3-benzodioxol-5-yl]methylidene}-3-nitrobenzohydrazide
Smiles: COc1c(/C=N/NC(=O)c2cccc(c2)[N+](=O)[O-])c(CC(Cl)C)c(c2c1OCO2)OC

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Molecular Weight: 449.85
Empirical Formula: C20H20ClN3O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.248
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 124
Number of rings: 3

     

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