COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK367938
Chemical Name: 3-ethyl-2-[(E)-(1-ethylquinolin-2(1H)-ylidene)methyl]-1,3-benzothiazol-3-ium
Smiles: CCn1/c(=C/c2sc3c([n+]2CC)cccc3)/ccc2c1cccc2

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Saltdata: CH3C6H4SO3-
Molecular Weight: 333.48
Empirical Formula: C21H21N2S

Physical State: Dry powder
Available Amount: 48 mg

Lipinsky:
logP: 0
Rotatable bonds: 3
H-donors: 0
H-acceptors: 0
PSA: 35
Number of rings: 4

     

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