COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK195716
Chemical Name: (2E)-2-(4-nitrophenyl)-3-{1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}prop-2-enenitrile
Smiles: N#C/C(=C/c1cccn1c1cccc(c1)C(F)(F)F)/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 383.33
Empirical Formula: C20H12F3N3O2

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 5.697
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 74
Number of rings: 3

     

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