COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK602238
Chemical Name: (2Z)-2-(2,3-dimethoxybenzylidene)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-4-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])cc(c2c1O/C(=C\c1cccc(c1OC)OC)/C2=O)C

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Molecular Weight: 454.52
Empirical Formula: C25H30N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.753
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 95
Number of rings: 4

     

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