COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL548580
Chemical Name: 4-hydroxy-3-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1,5-dioxaspiro[5.5]undec-3-en-2-one
Smiles: COc1c2c(CCN(C2C2=C(O)OC3(OC2=O)CCCCC3)C)cc2c1OCO2

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Molecular Weight: 403.43
Empirical Formula: C21H25NO7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.579
Rotatable bonds: 3
H-donors: 1
H-acceptors: 7
PSA: 86
Number of rings: 5

     

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