COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL514725
Chemical Name: methyl4-(3-cyano-4-imino-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinolin-2-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)c1cc2c3cc4OCOc4cc3CCn2c(=N)c1C#N

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Molecular Weight: 399.41
Empirical Formula: C23H17N3O4

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 3.598
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 5

     

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