COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550080
Chemical Name: (1S,5R)-3-[4-(6-methoxy[1,2,4]triazolo[4,3-b]pyridazin-3-yl)butanoyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: COc1ccc2n(n1)c(CCCC(=O)N1C[C@H]3C[C@@H](C1)C1N(C3)C(=O)CCC1)nn2

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Molecular Weight: 412.49
Empirical Formula: C21H28N6O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.065
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 92
Number of rings: 5

     

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