COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK592714
Chemical Name: 4-imino-2-[3-methoxy-4-(2-methylpropoxy)phenyl]-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: COc1cc(ccc1OCC(C)C)c1cc2c3cc4OCOc4cc3CCn2c(=N)c1C#N

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Molecular Weight: 443.5
Empirical Formula: C26H25N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.858
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 87
Number of rings: 5

     

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