COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK746513
Chemical Name: (1S,2S,3aR)-1-acetyl-2-(3-iodophenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Smiles: N#CC1(C#N)[C@H](c2cccc(c2)I)[C@H](N2[C@@H]1C=Cc1c2cccc1)C(=O)C

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Molecular Weight: 465.29
Empirical Formula: C22H16IN3O

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 3.746
Rotatable bonds: 0
H-donors: 0
H-acceptors: 1
PSA: 67
Number of rings: 4

     

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