In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 29 | No |
Popular Name: 2-[[(2S)-2-acetoxy-3-decoxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium 2-[[(2S)-2-acetoxy-3-decoxy-prop…
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) | -0.14 | 14.32 | -50.93 | 0 | 8 | 0 | 94 | 439.53 | 20 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50592-2-O | Oryctolagus Cuniculus (cluster #2 Of 8), Other | Other | 9 | 0.39 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50592 | Z50592 | Oryctolagus Cuniculus | 1200 | 0.29 | Functional ≤ 10μM |