COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK800168
Chemical Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-[3-(dimethylamino)propyl]-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1cc(ccc1OCCC(C)C)C1N(CCCN(C)C)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O

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Molecular Weight: 552.67
Empirical Formula: C31H40N2O7

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.453
Rotatable bonds: 13
H-donors: 1
H-acceptors: 7
PSA: 97
Number of rings: 4

     

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