COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547101
Chemical Name: N-{(1E)-1-[(9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-1,3-dioxo-3,9b-dihydrodibenzo[b,d]furan-2(1H)-ylidene]ethyl}glycylglycine
Smiles: O=C(CN/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/C)NCC(=O)O

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Molecular Weight: 458.42
Empirical Formula: C22H22N2O9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.942
Rotatable bonds: 8
H-donors: 5
H-acceptors: 9
PSA: 179
Number of rings: 3

     

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