COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541979
Chemical Name: [(1R,2S,3R,3aR)-2-(3,4-dimethoxyphenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl](phenyl)methanone
Smiles: COc1cc(ccc1OC)[C@@H]1[C@@H]([N+](=O)[O-])[C@@H]2N([C@H]1C(=O)c1ccccc1)c1ccccc1C=C2

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Molecular Weight: 456.5
Empirical Formula: C27H24N2O5

Physical State: Dry powder
Available Amount: 324 mg

Lipinsky:
logP: 4.762
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 84
Number of rings: 5

     

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