COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547523
Chemical Name: (2E,9bR)-6-acetyl-2-(1-{[2-(1H-benzimidazol-2-yl)-1-(4-fluorophenyl)ethyl]amino}ethylidene)-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Smiles: Fc1ccc(cc1)C(N/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/C)Cc1nc2c([nH]1)cccc2

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Molecular Weight: 581.6
Empirical Formula: C33H28FN3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.376
Rotatable bonds: 5
H-donors: 4
H-acceptors: 6
PSA: 141
Number of rings: 6

     

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