COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK400564
Chemical Name: (1R,3S,5R,7S)-3-(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]decane-1-carboxylicacid
Smiles: OC(=O)[C@]12C[C@@H]3C[C@H](C1)C[C@](C2)(C3)n1nc(nc1Br)[N+](=O)[O-]

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Molecular Weight: 371.19
Empirical Formula: C13H15BrN4O4

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 2.54
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 5

     

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