COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK973646
Chemical Name: 2-{[1-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2,6-dimethylpyridin-4(1H)-ylidene]methyl}-3-ethyl-1,3-benzothiazol-3-ium
Smiles: CC[n+]1c(/C=c/2\cc(C)n(c(c2)C)c2c(C)n(n(c2=O)c2ccccc2)C)sc2c1cccc2

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Saltdata: BF4-
Molecular Weight: 469.63
Empirical Formula: C28H29N4OS

Available Amount: 0 mg

Lipinsky:
logP: 0
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 58
Number of rings: 5

     

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