COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK091586
Chemical Name: [9-{3-bromo-4-[(4-chlorobenzyl)oxy]-5-methoxyphenyl}-3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydroacridin-10(1H)-yl]aceticacid
Smiles: COc1cc(cc(c1OCc1ccc(cc1)Cl)Br)C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)CC(=O)O

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Molecular Weight: 657
Empirical Formula: C33H35BrClNO6

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 6.578
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 93
Number of rings: 5

     

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