COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK391626
Chemical Name: N,N'-[(1E)-but-1-en-3-yne-1,4-diyldibenzene-3,1-diyl]bis(4-nitrobenzamide)
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])Nc1cccc(c1)/C=C/C#Cc1cccc(c1)NC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 532.51
Empirical Formula: C30H20N4O6

Physical State: Dry powder
Available Amount: 131 mg

Lipinsky:
logP: 6.778
Rotatable bonds: 1
H-donors: 2
H-acceptors: 6
PSA: 149
Number of rings: 4

     

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