COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK577175
Chemical Name: 14-(1,3-benzodioxol-5-yl)-3,3-dimethyl-2,3,4,6,7,14-hexahydro-1H-[1,3]dioxolo[6,7]isoquino[2,1-a]quinolin-1-one
Smiles: O=C1CC(C)(C)CC2=C1C(C=C1N2CCc2c1cc1c(c2)OCO1)c1ccc2c(c1)OCO2

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Molecular Weight: 443.5
Empirical Formula: C27H25NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.995
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 57
Number of rings: 7

     

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