COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK577174
Chemical Name: (5Z)-5-[2-(4-benzylpiperazin-1-yl)-5-nitrobenzylidene]-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C\c2cc(ccc2N2CCN(CC2)Cc2ccccc2)[N+](=O)[O-])/C(=N1)O

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Molecular Weight: 435.44
Empirical Formula: C22H21N5O5

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 2.862
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 134
Number of rings: 4

     

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