COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552171
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]-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]propanamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)CC(C1=C(O)[C@]3([C@@H](CC1=O)C)Oc1c(C3=O)c(OC)cc(c1Cl)OC)c1ccc(c(c1)OC)O)c[nH]2

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Molecular Weight: 705.16
Empirical Formula: C37H37ClN2O10

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.712
Rotatable bonds: 13
H-donors: 4
H-acceptors: 10
PSA: 165
Number of rings: 6

     

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