COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK065945
Chemical Name: [4-(3-chlorophenyl)piperazin-1-yl](4,5-dimethoxy-2-nitrophenyl)methanone
Smiles: COc1cc(C(=O)N2CCN(CC2)c2cccc(c2)Cl)c(cc1OC)[N+](=O)[O-]

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Molecular Weight: 405.84
Empirical Formula: C19H20ClN3O5

Physical State: Dry powder
Available Amount: 228 mg

Lipinsky:
logP: 3.555
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 87
Number of rings: 3

     

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