COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550702
Chemical Name: ethyl2-(4-{[(2S,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-2',3-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[3]en]-4'-yl]amino}-3-methoxyphenyl)-3,3,3-trifluoro-2-hydroxypropanoate
Smiles: CCOC(=O)C(C(F)(F)F)(c1ccc(c(c1)OC)NC1=CC(=O)[C@]2([C@@H](C1)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)O

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Molecular Weight: 613.97
Empirical Formula: C28H27ClF3NO9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.705
Rotatable bonds: 8
H-donors: 2
H-acceptors: 9
PSA: 129
Number of rings: 4

     

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