COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547934
Chemical Name: (2E,9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-2-[1-({2-[(1-methyl-1H-1,2,4-triazol-5-yl)amino]ethyl}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)/NCCNc1ncnn1C

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Molecular Weight: 467.48
Empirical Formula: C23H25N5O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.092
Rotatable bonds: 6
H-donors: 4
H-acceptors: 6
PSA: 155
Number of rings: 4

     

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