COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741700
Chemical Name: (4Z)-2-(4-nitrophenyl)-4-{[(4-nitrophenyl)amino]methylidene}-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: [O-][N+](=O)c1ccc(cc1)N/C=C/1\C(=O)N(N=C1C(F)(F)F)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 421.29
Empirical Formula: C17H10F3N5O5

Physical State: Dry powder
Available Amount: 42 mg

Lipinsky:
logP: 4.894
Rotatable bonds: 0
H-donors: 1
H-acceptors: 5
PSA: 136
Number of rings: 3

     

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