COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL437917
Chemical Name: 1-[(4E)-4-{2-[4-chloro-3-(trifluoromethyl)phenyl]hydrazinylidene}-3,5-diiminopyrazolidin-1-yl]ethanone
Smiles: CC(=O)N1NC(=N)/C(=N\Nc2ccc(c(c2)C(F)(F)F)Cl)/C1=N

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Molecular Weight: 346.7
Empirical Formula: C12H10ClF3N6O

Physical State: Dry powder
Available Amount: 1298 mg

Lipinsky:
logP: 1.566
Rotatable bonds: 0
H-donors: 4
H-acceptors: 1
PSA: 104
Number of rings: 2

     

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