COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK848287
Chemical Name: (2Z)-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1cccs1)/C2=O

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Molecular Weight: 370.47
Empirical Formula: C20H22N2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.02
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 85
Number of rings: 4

     

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