COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL035004
Chemical Name: (2Z)-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-6-hydroxy-7-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1-benzofuran-3(2H)-one
Smiles: OCCN1CCN(CC1)Cc1c(O)ccc2c1O/C(=C\c1cn(c3c1cc(OC)cc3)CC)/C2=O

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Molecular Weight: 477.56
Empirical Formula: C27H31N3O5

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 2.174
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 87
Number of rings: 5

     

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