COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK672607
Chemical Name: 4-(4-bromophenyl)-2-[3-(2,5-dimethylphenyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazole
Smiles: Brc1ccc(cc1)c1csc(n1)N1N=C(CC1c1cccc(c1)[N+](=O)[O-])c1cc(C)ccc1C

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Saltdata: HBr
Molecular Weight: 533.45
Empirical Formula: C26H21BrN4O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.277
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 102
Number of rings: 5

     

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