COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL155712
Chemical Name: N-[(2Z)-3,4,5,6,7,8-hexahydro-2H-cyclohepta[d][1,3]thiazol-2-ylidene]-2-{3-[4-(methylsulfanyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetamide
Smiles: CSc1ccc(cc1)c1ccc(=O)n(n1)CC(=O)/N=c/1\sc2c([nH]1)CCCCC2

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Molecular Weight: 426.56
Empirical Formula: C21H22N4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.834
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 124
Number of rings: 4

     

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