COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK367953
Chemical Name: 3-ethyl-2-[(E)-(1-ethyl-6-methylquinolin-2(1H)-ylidene)methyl]-5-hydroxy-1,3-benzothiazol-3-ium
Smiles: CCn1/c(=C/c2sc3c([n+]2CC)cc(cc3)O)/ccc2c1ccc(c2)C

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Saltdata: I-
Molecular Weight: 363.5
Empirical Formula: C22H23N2OS

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 0
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 55
Number of rings: 4

     

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