COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552549
Chemical Name: (2R,3'E,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-3'-[({[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]methyl}amino)methylidene]-2'H,3H,4'H-spiro[1-benzofuran-2,1'-cyclohexane]-2',3,4'-trione
Smiles: COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=O)/C(=C\NCc2onc(n2)C(C)C)/C1=O)Cl

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Molecular Weight: 489.91
Empirical Formula: C23H24ClN3O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.73
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 129
Number of rings: 4

     

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