In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 29th, 2010 | 24 | No |
Popular Name: N-[(1S)-2-[(N'E)-N'-benzylidenehydrazino]-1-methyl-2-oxo-ethyl]-4-methoxy-benzamide N-[(1S)-2-[(N'E)-N'-benzylideneh…
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Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.59 | 5.58 | -14.16 | 2 | 6 | 0 | 80 | 325.368 | 6 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50609-1-O | Simian Immunodeficiency Virus (cluster #1 Of 2), Other | Other | 6410 | 0.30 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50609 | Z50609 | Simian Immunodeficiency Virus | 6410 | 0.30 | Functional ≤ 10μM |