COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK550221
Chemical Name: (6aR,6bS,9aR,10S)-N-(4-nitrophenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxamide
Smiles: O=C([C@@H]1[C@@H]2C(=O)NC(=O)[C@@H]2[C@@H]2N1c1ccccc1C=C2)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 404.38
Empirical Formula: C21H16N4O5

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.529
Rotatable bonds: 0
H-donors: 2
H-acceptors: 5
PSA: 124
Number of rings: 5

     

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