COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK340906
Chemical Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
Smiles: O=C(Nc1cc(ccc1Cl)C(F)(F)F)CCCn1nc(c(c1C)[N+](=O)[O-])C

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Molecular Weight: 404.78
Empirical Formula: C16H16ClF3N4O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.139
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 92
Number of rings: 2

     

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