In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2005 | 18 | No |
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) | 2.75 | -5.88 | -23.27 | 2 | 4 | 0 | 74 | 282.342 | 3 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50607-4-O | Human Immunodeficiency Virus 1 (cluster #4 Of 10), Other | Other | 25 | 0.59 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50607 | Z50607 | Human Immunodeficiency Virus 1 | 25.4 | 0.59 | Functional ≤ 10μM |