COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL513632
Chemical Name: (2E)-1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)-3-(4-methoxyphenyl)prop-2-en-1-one
Smiles: COc1ccc(cc1)/C=C/C(=O)c1c2CCN(Cc2c(c2c1OCO2)OC)C

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Molecular Weight: 381.43
Empirical Formula: C22H23NO5

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 3.905
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 57
Number of rings: 4

     

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