COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK023670
Chemical Name: 2-(4-hydroxyphenyl)-5-[(4-nitrophenyl)carbonyl]-1H-isoindole-1,3(2H)-dione
Smiles: Oc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 388.34
Empirical Formula: C21H12N2O6

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 2.497
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 120
Number of rings: 4

     

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