COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL000762
Chemical Name: 2- (2- hydroxy- 4- nitrophenyl)- 3a,4,7,7a- tetrahydro- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1C2CC=CCC2C(=O)N1c1ccc(cc1O)[N+](=O)[O-]

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Molecular Weight: 288.26
Empirical Formula: C14H12N2O5

Physical State: Dry powder
Available Amount: 7184 mg

Lipinsky:
logP: 1.105
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 103
Number of rings: 3

     

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