COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK295043
Chemical Name: (5-bromo-2-methoxyphenyl)[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]methanone
Smiles: COc1ccc(cc1C(=O)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])Cl)Br

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Molecular Weight: 454.71
Empirical Formula: C18H17BrClN3O4

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 4.9
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 78
Number of rings: 3

     

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