COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL363178
Chemical Name: 3-ethyl-2-[(1E,3E,5E)-5-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)penta-1,3-dien-1-yl]-1,3-benzothiazol-3-ium
Smiles: CC[n+]1c(/C=C/C=C/C=c\2/sc3c(n2CC)cccc3)sc2c1cccc2

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Saltdata: I-
Molecular Weight: 391.58
Empirical Formula: C23H23N2S2

Physical State: Dry powder
Available Amount: 164 mg

Lipinsky:
logP: 0
Rotatable bonds: 5
H-donors: 0
H-acceptors: 0
PSA: 60
Number of rings: 4

     

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