COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL002880
Chemical Name: 2-(4-nitro-3-oxobutyl)-1H-isoindole-1,3(2H)-dione
Smiles: O=C(C[N+](=O)[O-])CCN1C(=O)c2c(C1=O)cccc2

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Molecular Weight: 262.22
Empirical Formula: C12H10N2O5

Physical State: Dry powder
Available Amount: 3476 mg

Lipinsky:
logP: 2.07
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 100
Number of rings: 2

     

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