COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK553784
Chemical Name: 1-[(1S,2R,3S,10bR)-2-(4-bromophenyl)-1-nitro-1,2,3,10b-tetrahydropyrrolo[2,1-a]phthalazin-3-yl]ethanone
Smiles: [O-][N+](=O)[C@H]1[C@H](c2ccc(cc2)Br)[C@H](N2[C@@H]1c1ccccc1C=N2)C(=O)C

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Molecular Weight: 414.26
Empirical Formula: C19H16BrN3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.42
Rotatable bonds: 0
H-donors: 0
H-acceptors: 3
PSA: 78
Number of rings: 4

     

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