COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK571823
Chemical Name: 2-[(3Z)-3-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-2-oxopropyl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C(/C=C/1\NCCc2c1cc1OCOc1c2)CN1C(=O)c2c(C1=O)cccc2

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Molecular Weight: 376.37
Empirical Formula: C21H16N2O5

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.452
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 84
Number of rings: 5

     

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