COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL549428
Chemical Name: 2-{[(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}-4,5-dimethoxybenzoicacid
Smiles: COc1cc(NC2=CC(=O)[C@]3([C@@H](C2)C)Oc2c(C3=O)c(OC)cc(c2Cl)OC)c(cc1OC)C(=O)O

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Molecular Weight: 517.92
Empirical Formula: C25H24ClNO9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.953
Rotatable bonds: 6
H-donors: 2
H-acceptors: 9
PSA: 129
Number of rings: 4

     

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