COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL001093
Chemical Name: (1S,2S,3aR)-1-acetyl-2-[3-ethoxy-4-(propan-2-yloxy)phenyl]-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Smiles: CCOc1cc(ccc1OC(C)C)[C@@H]1[C@@H](C(=O)C)N2[C@@H](C1(C#N)C#N)C=Cc1c2cccc1

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Molecular Weight: 441.53
Empirical Formula: C27H27N3O3

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 3.862
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 86
Number of rings: 4

     

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