COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK528210
Chemical Name: hexa-2,4-diyne-1,6-diylbis(4-nitrobenzoate)
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])OCC#CC#CCOC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 408.32
Empirical Formula: C20H12N2O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.684
Rotatable bonds: 4
H-donors: 0
H-acceptors: 8
PSA: 144
Number of rings: 2

     

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