COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK669494
Chemical Name: 2,2'-[(1E)-but-1-en-3-yne-1,4-diyldibenzene-4,1-diyl]bis(5-nitro-1H-isoindole-1,3(2H)-dione)
Smiles: O=C1c2ccc(cc2C(=O)N1c1ccc(cc1)/C=C/C#Cc1ccc(cc1)N1C(=O)c2c(C1=O)ccc(c2)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 584.5
Empirical Formula: C32H16N4O8

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 5.676
Rotatable bonds: 0
H-donors: 0
H-acceptors: 8
PSA: 166
Number of rings: 6

     

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