COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL515710
Chemical Name: (2Z)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-1-phenylethanone
Smiles: O=C(c1ccccc1)/C=C/1\NCCc2c1cc1OCOc1c2

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Molecular Weight: 293.32
Empirical Formula: C18H15NO3

Physical State: Dry powder
Available Amount: 63 mg

Lipinsky:
logP: 3.59
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 47
Number of rings: 4

     

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