COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL033111
Chemical Name: (2Z)-2-(2,4-dichlorobenzylidene)-7-[(4-ethylpiperazin-1-yl)methyl]-6-hydroxy-1-benzofuran-3(2H)-one
Smiles: CCN1CCN(CC1)Cc1c(O)ccc2c1O/C(=C\c1ccc(cc1Cl)Cl)/C2=O

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Molecular Weight: 433.33
Empirical Formula: C22H22Cl2N2O3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.12
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 53
Number of rings: 4

     

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