COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550036
Chemical Name: 4-{5-[1-(7-chloro-4'-hydroxy-4,6-dimethoxy-6'-methyl-2',3-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[3]en]-3'-yl)-3-methoxy-3-oxopropyl]furan-2-yl}benzoicacid
Smiles: COC(=O)CC(C1=C(O)CC(C2(C1=O)Oc1c(C2=O)c(OC)cc(c1Cl)OC)C)c1ccc(o1)c1ccc(cc1)C(=O)O

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Molecular Weight: 611
Empirical Formula: C31H27ClO11

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.524
Rotatable bonds: 9
H-donors: 2
H-acceptors: 11
PSA: 158
Number of rings: 5

     

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