COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550378
Chemical Name: (2S,6'R)-4'-{[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]amino}-7-chloro-4,6-dimethoxy-6'-methyl-2'H,3H-spiro[1-benzofuran-2,1'-cyclohex[3]ene]-2',3-dione
Smiles: COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=CC1=O)Nc1ccc(c(c1)c1nc2c(o1)cccc2)O)Cl

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Molecular Weight: 546.96
Empirical Formula: C29H23ClN2O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 7.086
Rotatable bonds: 4
H-donors: 2
H-acceptors: 7
PSA: 120
Number of rings: 6

     

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