COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK374739
Chemical Name: 2,2'-{(2-carboxybenzene-1,4-diyl)bis[imino(E)ethene-2,1-diyl]}bis(3-ethyl-4,5-dihydro-1,3-thiazol-3-ium)
Smiles: CC[N+]1=C(/C=C/Nc2ccc(c(c2)C(=O)O)N/C=C/C2=[N+](CC)CCS2)SCC1

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Saltdata: 2I-
Molecular Weight: 432.61
Empirical Formula: C21H28N4O2S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0
Rotatable bonds: 6
H-donors: 3
H-acceptors: 2
PSA: 117
Number of rings: 3

     

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