COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK535194
Chemical Name: N'-(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-3-nitrobenzohydrazide
Smiles: O=C1C(=C/C(=N/NC(=O)c2cccc(c2)[N+](=O)[O-])/C=C1C(C)(C)C)C(C)(C)C

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Molecular Weight: 383.45
Empirical Formula: C21H25N3O4

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 5.498
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 104
Number of rings: 2

     

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