COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK377886
Chemical Name: 1-ethyl-2-[(Z)-(3-ethyl-5-hydroxy-1,3-benzothiazol-2(3H)-ylidene)methyl]-6-methylquinolinium
Smiles: CC[n+]1c(ccc2c1ccc(c2)C)/C=c/1\sc2c(n1CC)cc(cc2)O

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Saltdata: CH3C6H4SO3-
Molecular Weight: 363.5
Empirical Formula: C22H23N2OS

Physical State: Dry powder
Available Amount: 743 mg

Lipinsky:
logP: 0
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 52
Number of rings: 4

     

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