COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL549298
Chemical Name: 3-[(2S,6'R)-7-chloro-2'-hydroxy-4,6-dimethoxy-6'-methyl-3,4'-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[2]en]-3'-yl]-N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]-3-(4-hydroxy-3-methoxyphenyl
Smiles: COc1cc(ccc1O)C(C1=C(O)[C@]2([C@@H](CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)NCCc1cn2c(n1)SCC2

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Molecular Weight: 684.17
Empirical Formula: C33H34ClN3O9S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.949
Rotatable bonds: 12
H-donors: 3
H-acceptors: 9
PSA: 183
Number of rings: 6

     

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