COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK234912
Chemical Name: [4-(4-nitrophenyl)piperazin-1-yl][2-phenyl-5-(phenylethynyl)-1-benzofuran-7-yl]methanone
Smiles: O=C(c1cc(C#Cc2ccccc2)cc2c1oc(c2)c1ccccc1)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 527.58
Empirical Formula: C33H25N3O4

Physical State: Dry powder
Available Amount: 229 mg

Lipinsky:
logP: 7.007
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 82
Number of rings: 6

     

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