COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK115842
Chemical Name: 5-methyl-2-(2-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Smiles: CC1=CCC2C(C1)C(=O)N(C2=O)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 286.29
Empirical Formula: C15H14N2O4

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 1.717
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 83
Number of rings: 3

     

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