COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK065824
Chemical Name: 7-tert-butyl-N'-[(1Z,2E)-3-(3-nitrophenyl)prop-2-en-1-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide
Smiles: O=C(C1COc2c(O1)cc(cc2)C(C)(C)C)N/N=C\C=C\c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 409.44
Empirical Formula: C22H23N3O5

Physical State: Dry powder
Available Amount: 267 mg

Lipinsky:
logP: 5.22
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 105
Number of rings: 3

     

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