COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK617489
Chemical Name: (2Z)-2-(1-benzofuran-2-ylmethylidene)-4-methyl-7-[(2-methylpiperidinium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: Cc1cc([O-])c(c2c1C(=O)/C(=C/c1cc3c(o1)cccc3)/O2)C[NH+]1CCCCC1C

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Molecular Weight: 403.48
Empirical Formula: C25H25NO4

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 4.91
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 66
Number of rings: 5

     

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