COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK054119
Chemical Name: 2-[(E)-2-(3,4-dihydroquinolin-1(2H)-yl)ethenyl]-3-ethyl-5,6-dimethyl-1,3-benzothiazol-3-ium
Smiles: CC[n+]1c(/C=C/N2CCCc3c2cccc3)sc2c1cc(C)c(c2)C

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Saltdata: I-
Molecular Weight: 349.52
Empirical Formula: C22H25N2S

Physical State: Dry powder
Available Amount: 15 mg

Lipinsky:
logP: 0
Rotatable bonds: 2
H-donors: 0
H-acceptors: 0
PSA: 35
Number of rings: 4

     

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