COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL546560
Chemical Name: (2E,9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-2-[1-({[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl}amino)ethylidene]dibenzo[b,d]furan-1,3(2H,9bH)-dione
Smiles: C/C(=C\1/C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/NCc1onc(n1)COc1ccccc1

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Molecular Weight: 531.52
Empirical Formula: C28H25N3O8

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 4.438
Rotatable bonds: 7
H-donors: 3
H-acceptors: 8
PSA: 161
Number of rings: 5

     

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