COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552325
Chemical Name: 3-(1,3-benzodioxol-5-yl)-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-(5-oxopyrrolidin-2-yl)-1,2,4-oxadiazol-3-yl]methyl}pr
Smiles: COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=O)C(=C1O)C(c1ccc2c(c1)OCO2)CC(=O)NCc1noc(n1)C1CCC(=O)N1)Cl

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Molecular Weight: 695.08
Empirical Formula: C33H31ClN4O11

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 2.483
Rotatable bonds: 10
H-donors: 3
H-acceptors: 11
PSA: 197
Number of rings: 7

     

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