COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK394394
Chemical Name: 4-[(Z)-{2-[(7-tert-butyl-2,3-dihydro-1,4-benzodioxin-2-yl)carbonyl]hydrazinylidene}methyl]-2-methoxyphenyl4-nitrobenzoate
Smiles: COc1cc(/C=N\NC(=O)C2COc3c(O2)cc(cc3)C(C)(C)C)ccc1OC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 533.54
Empirical Formula: C28H27N3O8

Physical State: Dry powder
Available Amount: 268 mg

Lipinsky:
logP: 6.598
Rotatable bonds: 5
H-donors: 1
H-acceptors: 8
PSA: 141
Number of rings: 4

     

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