COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK008834
Chemical Name: (2-chloro-4,5-difluorophenyl){4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}methanone
Smiles: Cc1nn(c(c1)C)c1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)c1cc(F)c(cc1Cl)F

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Molecular Weight: 475.88
Empirical Formula: C22H20ClF2N5O3

Physical State: Dry powder
Available Amount: 393 mg

Lipinsky:
logP: 4.444
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 87
Number of rings: 4

     

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