COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK148745
Chemical Name: (3,5-dichloro-4-methoxyphenyl)[4-(4-nitro-3-{[4-(propan-2-yl)benzyl]amino}phenyl)piperazin-1-yl]methanone
Smiles: COc1c(Cl)cc(cc1Cl)C(=O)N1CCN(CC1)c1ccc(c(c1)NCc1ccc(cc1)C(C)C)[N+](=O)[O-]

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Molecular Weight: 557.48
Empirical Formula: C28H30Cl2N4O4

Physical State: Dry powder
Available Amount: 258 mg

Lipinsky:
logP: 7.827
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 90
Number of rings: 4

     

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