COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK727112
Chemical Name: 1-benzofuran-2-yl{4-[4-nitro-3-(propan-2-ylamino)phenyl]piperazin-1-yl}methanone
Smiles: CC(Nc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)c1cc2c(o1)cccc2)C

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Molecular Weight: 408.46
Empirical Formula: C22H24N4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.886
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 94
Number of rings: 4

     

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