COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK305023
Chemical Name: 1-{2-[3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-5-(pentafluorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Smiles: Brc1ccc(cc1)C1=NN(C(C1)c1ccccc1)C(=O)CN1N=NC2C1C(=O)N(C2=O)c1c(F)c(F)c(c(c1F)F)F

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Molecular Weight: 647.36
Empirical Formula: C27H16BrF5N6O3

Physical State: Dry powder
Available Amount: 14 mg

Lipinsky:
logP: 2.339
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 98
Number of rings: 6

     

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