COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL267084
Chemical Name: 3-(4-bromophenyl)-2-[(2,4-dinitrophenyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Brc1ccc(cc1)n1c(nc2c(c1=O)c1CCCc1s2)Sc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 545.39
Empirical Formula: C21H13BrN4O5S2

Available Amount: 0 mg

Lipinsky:
logP: 6.541
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 177
Number of rings: 5

     

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