COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527519
Chemical Name: 1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-5-(4-methoxy-2,3,6-trimethylphenyl)-3-methylpent-1-yn-3-ol
Smiles: COc1cc(C)c(c(c1C)C)CCC(C#CC1N(C)CCc2c1c(OC)c1c(c2)OCO1)(O)C

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Saltdata: HCl
Molecular Weight: 465.59
Empirical Formula: C28H35NO5

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 5.799
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 60
Number of rings: 4

     

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