COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL178512
Chemical Name: methyl9-methyl-2-[2-(3-nitro-1H-1,2,4-triazol-1-yl)ethyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Smiles: COC(=O)c1sc2c(c1C)c1nc(nn1cn2)CCn1cnc(n1)[N+](=O)[O-]

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Molecular Weight: 388.37
Empirical Formula: C14H12N8O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.706
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 174
Number of rings: 4

     

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