COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK126532
Chemical Name: 3-(2-hydroxyethyl)-2-{(1E,3E,5E)-4-methyl-6-[methyl(phenyl)amino]hexa-1,3,5-trien-1-yl}-1,3-benzothiazol-3-ium
Smiles: OCC[n+]1c(/C=C/C=C(/C=C/N(c2ccccc2)C)\C)sc2c1cccc2

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Saltdata: I-
Molecular Weight: 377.53
Empirical Formula: C23H25N2OS

Available Amount: 0 mg

Lipinsky:
logP: 0
Rotatable bonds: 6
H-donors: 1
H-acceptors: 1
PSA: 55
Number of rings: 3

     

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