COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL026728
Chemical Name: N-[2-(carboxymethyl)-5-nitro-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinolin-6-yl]glycine
Smiles: OC(=O)CNc1c(cc2c3c1cccc3c(=O)n(c2=O)CC(=O)O)[N+](=O)[O-]

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Molecular Weight: 373.28
Empirical Formula: C16H11N3O8

Available Amount: 0 mg

Lipinsky:
logP: -0.192
Rotatable bonds: 6
H-donors: 3
H-acceptors: 8
PSA: 169
Number of rings: 3

     

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