COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL409223
Chemical Name: methyl(2Z)-5-methyl-2-{[(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate
Smiles: COC(=O)c1[nH]/c(=N/C(=O)Cn2nc3CCCCCc3cc2=O)/sc1C

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Molecular Weight: 376.44
Empirical Formula: C17H20N4O4S

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 1.14
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 125
Number of rings: 3

     

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