COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL221359
Chemical Name: 6-(3-methyl-4-nitrophenyl)-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: [O-][N+](=O)c1ccc(cc1C)c1nn2c(s1)nnc2C12CC3CC(C2)CC(C1)C3

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Molecular Weight: 395.49
Empirical Formula: C20H21N5O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.017
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 117
Number of rings: 7

     

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