COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK706049
Chemical Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-(3-nitrophenyl)-1-(tetrahydrofuran-2-ylmethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1C(=C(C(N1CC1CCCO1)c1cccc(c1)[N+](=O)[O-])C(=O)c1ccc2c(c1)OCCO2)O

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Molecular Weight: 466.45
Empirical Formula: C24H22N2O8

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.701
Rotatable bonds: 6
H-donors: 1
H-acceptors: 8
PSA: 131
Number of rings: 5

     

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