COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551787
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-[(2R)-2-hydroxypropyl]-3-[4-(methylsulfanyl)phenyl]propanamide
Smiles: COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=O)C(=C1O)C(c1ccc(cc1)SC)CC(=O)NCC(O)C)Cl

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Molecular Weight: 590.09
Empirical Formula: C29H32ClNO8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.991
Rotatable bonds: 7
H-donors: 3
H-acceptors: 8
PSA: 156
Number of rings: 4

     

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