COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK578199
Chemical Name: (1Z)-5-(4-chloro-3-methylphenoxy)-1-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)pentan-2-one
Smiles: O=C(/C=C/1\NCCc2c1cc1OCOc1c2)CCCOc1ccc(c(c1)C)Cl

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Molecular Weight: 399.87
Empirical Formula: C22H22ClNO4

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 5.144
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 56
Number of rings: 4

     

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