COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK150195
Chemical Name: (3-chlorophenyl){4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Smiles: Clc1cccc(c1)C(=O)N1CCN(CC1)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

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Molecular Weight: 458.78
Empirical Formula: C18H14ClF3N4O5

Physical State: Dry powder
Available Amount: 137 mg

Lipinsky:
logP: 5.682
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 115
Number of rings: 3

     

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