COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL035083
Chemical Name: (2Z)-2-[(1-ethyl-1H-indol-3-yl)methylidene]-7-[(4-ethylpiperazin-1-yl)methyl]-6-hydroxy-1-benzofuran-3(2H)-one
Smiles: CCN1CCN(CC1)Cc1c(O)ccc2c1O/C(=C\c1cn(c3c1cccc3)CC)/C2=O

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Molecular Weight: 431.53
Empirical Formula: C26H29N3O3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.057
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 57
Number of rings: 5

     

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