COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550625
Chemical Name: methyl3-(7-chloro-4'-hydroxy-4,6-dimethoxy-6'-methyl-2',3-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[3]en]-3'-yl)-3-(4-hydroxy-3-methoxyphenyl)propanoate
Smiles: COC(=O)CC(C1=C(O)CC(C2(C1=O)Oc1c(C2=O)c(OC)cc(c1Cl)OC)C)c1ccc(c(c1)OC)O

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Molecular Weight: 546.96
Empirical Formula: C27H27ClO10

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.768
Rotatable bonds: 10
H-donors: 2
H-acceptors: 10
PSA: 137
Number of rings: 4

     

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