COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK970692
Chemical Name: 1-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]pyridin-2(1H)-iminium
Smiles: O=C(c1ccc(c(c1)O)O)Cn1ccccc1=[NH2+]

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Saltdata: Br-
Molecular Weight: 245.26
Empirical Formula: C13H13N2O3

Available Amount: 0 mg

Lipinsky:
logP: 0.337
Rotatable bonds: 5
H-donors: 4
H-acceptors: 3
PSA: 86
Number of rings: 2

     

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