COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL359547
Chemical Name: 5-({(Z)-[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-6-nitro-1,3-dihydro-2H-benzimidazol-2-one
Smiles: Brc1ccc(cc1)N1N=C(/C(=C/Nc2cc3[nH]c(=O)[nH]c3cc2[N+](=O)[O-])/C1=O)C

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Molecular Weight: 457.24
Empirical Formula: C18H13BrN6O4

Physical State: Dry powder
Available Amount: 215 mg

Lipinsky:
logP: 3.345
Rotatable bonds: 0
H-donors: 3
H-acceptors: 4
PSA: 131
Number of rings: 4

     

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