COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551167
Chemical Name: (2E,9bR)-6-acetyl-7,9-dihydroxy-2-[1-({2-[(2-hydroxyethyl)amino]-5-(4H-1,2,4-triazol-4-yl)phenyl}amino)ethylidene]-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Smiles: OCCNc1ccc(cc1N/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/C)n1cnnc1

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Molecular Weight: 545.55
Empirical Formula: C28H27N5O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.195
Rotatable bonds: 6
H-donors: 5
H-acceptors: 7
PSA: 175
Number of rings: 5

     

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