COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK971397
Chemical Name: 3-benzyl-2-{[1-(1-hydroxybutan-2-yl)-2,6-dimethylpyridin-4(1H)-ylidene]methyl}-1,3-benzothiazol-3-ium
Smiles: CCC(n1c(C)c/c(=C/c2sc3c([n+]2Cc2ccccc2)cccc3)/cc1C)CO

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Saltdata: I-
Molecular Weight: 417.6
Empirical Formula: C26H29N2OS

Available Amount: 0 mg

Lipinsky:
logP: 0
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 55
Number of rings: 4

     

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