In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2008 | 18 | No |
Popular Name: 1-methyl-4-[(R)-[(S)-p-tolylsulfinyl]sulfinyl]benzene 1-methyl-4-[(R)-[(S)-p-tolylsulf…
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) | 4.18 | 6.23 | -11.74 | 0 | 2 | 0 | 34 | 278.398 | 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 | 11 | 0.62 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50607 | Z50607 | Human Immunodeficiency Virus 1 | 11 | 0.62 | Functional ≤ 10μM |