COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL466340
Chemical Name: (4Z)-6,7-dimethoxy-4-[4-(propan-2-yl)benzylidene]-1,4-dihydro-3H-isochromen-3-one
Smiles: COc1cc2c(cc1OC)COC(=O)/C/2=C\c1ccc(cc1)C(C)C

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Molecular Weight: 338.4
Empirical Formula: C21H22O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.484
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 44
Number of rings: 3

     

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