COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL442146
Chemical Name: 1-(2-chlorophenyl)-3-{4-[(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)carbonyl]-1,2,3-thiadiazol-5-yl}urea
Smiles: O=C(Nc1ccccc1Cl)Nc1snnc1C(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

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Molecular Weight: 470.94
Empirical Formula: C21H19ClN6O3S

Physical State: Dry powder
Available Amount: 71 mg

Lipinsky:
logP: 1.418
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 135
Number of rings: 5

     

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