COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545789
Chemical Name: [(1S,2R,3S)-2-(3,4-dimethoxyphenyl)-1-nitro-1,2,3,10b-tetrahydropyrrolo[2,1-a]phthalazin-3-yl](phenyl)methanone
Smiles: COc1cc(ccc1OC)[C@H]1[C@H]([N+](=O)[O-])C2N([C@@H]1C(=O)c1ccccc1)N=Cc1c2cccc1

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Molecular Weight: 457.49
Empirical Formula: C26H23N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.069
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 96
Number of rings: 5

     

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