COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK295977
Chemical Name: 5-nitro-2-(3-{5-[3-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenoxy]-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl}phenyl)-1H-isoindole-1,3(2H)-dione
Smiles: O=C1c2ccc(cc2C(=O)N1c1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-])Oc1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-]

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Molecular Weight: 695.56
Empirical Formula: C36H17N5O11

Physical State: Dry powder
Available Amount: 24 mg

Lipinsky:
logP: 4.215
Rotatable bonds: 2
H-donors: 0
H-acceptors: 11
PSA: 213
Number of rings: 8

     

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