COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673300
Chemical Name: (4Z)-4-({[4-(4-bromophenoxy)phenyl]amino}methylidene)-2-(4-nitrophenyl)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Brc1ccc(cc1)Oc1ccc(cc1)N/C=C/1\C(=O)N(N=C1C(F)(F)F)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 547.29
Empirical Formula: C23H14BrF3N4O4

Available Amount: 0 mg

Lipinsky:
logP: 7.361
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 4

     

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