COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK039531
Chemical Name: 1-[4-(4-{[(E)-(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]amino}phenyl)piperazin-1-yl]ethanone
Smiles: COc1cc(cc(c1O)/C=N/c1ccc(cc1)N1CCN(CC1)C(=O)C)[N+](=O)[O-]

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Molecular Weight: 398.42
Empirical Formula: C20H22N4O5

Physical State: Dry powder
Available Amount: 244 mg

Lipinsky:
logP: 2.251
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 111
Number of rings: 3

     

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