COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL181247
Chemical Name: methyl2-({[5-(3-nitrophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCC2)NC(=O)c1cc(nc2n1ncn2)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 464.46
Empirical Formula: C21H16N6O5S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.828
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 172
Number of rings: 5

     

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