COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK801198
Chemical Name: 1-[3-(diethylamino)propyl]-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-(3-ethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1cccc(c1)C1N(CCCN(CC)CC)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O

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Molecular Weight: 494.59
Empirical Formula: C28H34N2O6

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 4.753
Rotatable bonds: 11
H-donors: 1
H-acceptors: 6
PSA: 88
Number of rings: 4

     

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