COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL549970
Chemical Name: methyl3-(7-chloro-4'-hydroxy-4,6-dimethoxy-6'-methyl-2',3-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[3]en]-3'-yl)-3-{3-methoxy-2-[2-(4-methoxyphenyl)ethoxy]phenyl}propanoate
Smiles: COC(=O)CC(C1=C(O)CC(C2(C1=O)Oc1c(C2=O)c(OC)cc(c1Cl)OC)C)c1cccc(c1OCCc1ccc(cc1)OC)OC

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Molecular Weight: 681.14
Empirical Formula: C36H37ClO11

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.332
Rotatable bonds: 12
H-donors: 1
H-acceptors: 11
PSA: 136
Number of rings: 5

     

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