COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL561479
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-[(5-oxo-1-phenyl-2,5-dihydro-1H-pyrazol-3-yl)methyl]-3-(3,4,5-trimethoxyphenyl)pro
Smiles: COc1cc(cc(c1OC)OC)C(C1=C(O)[C@]2([C@@H](CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)NCc1[nH]n(c(=O)c1)c1ccccc1

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Molecular Weight: 748.19
Empirical Formula: C38H38ClN3O11

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.647
Rotatable bonds: 10
H-donors: 3
H-acceptors: 11
PSA: 171
Number of rings: 6

     

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