COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK148827
Chemical Name: (4-methylphenyl)(4-{4-nitro-3-[(1-phenylethyl)amino]phenyl}piperazin-1-yl)methanone
Smiles: Cc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)NC(c1ccccc1)C)[N+](=O)[O-]

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Molecular Weight: 444.53
Empirical Formula: C26H28N4O3

Physical State: Dry powder
Available Amount: 198 mg

Lipinsky:
logP: 5.266
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 81
Number of rings: 4

     

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