COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK823752
Chemical Name: 5-(4-tert-butylphenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-1-(3-methoxypropyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COCCCN1C(=O)C(=C(C1c1ccc(cc1)C(C)(C)C)C(=O)c1ccc2c(c1)OCCO2)O

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Molecular Weight: 465.55
Empirical Formula: C27H31NO6

Physical State: Dry powder
Available Amount: 97 mg

Lipinsky:
logP: 4.788
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 85
Number of rings: 4

     

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