COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK150280
Chemical Name: (3-chlorophenyl)[4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}phenyl)piperazin-1-yl]methanone
Smiles: Clc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

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Molecular Weight: 619
Empirical Formula: C28H26ClF3N6O5

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: 7.589
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 121
Number of rings: 5

     

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