COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK964512
Chemical Name: 3-(4-bromothiophen-2-yl)-5-{[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazole
Smiles: CCn1c(nnc1c1scc(c1)Br)SCn1nc(c(c1C)[N+](=O)[O-])C

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Molecular Weight: 443.35
Empirical Formula: C14H15BrN6O2S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.207
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 147
Number of rings: 3

     

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