COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL333189
Chemical Name: methyl4-(3-acetyl-1,1-dicyano-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-2-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1C(C(=O)C)N2C(C1(C#N)C#N)c1ccccc1C=C2

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Molecular Weight: 397.43
Empirical Formula: C24H19N3O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.199
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 94
Number of rings: 4

     

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