COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL497095
Chemical Name: methyl4-[({[3-(propan-2-yl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1ccc2n(n1)c(nn2)C(C)C

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Molecular Weight: 385.45
Empirical Formula: C18H19N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.817
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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