| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 22nd, 2009 | 34 | Yes |
Popular Name: [2-[2-(2-aminoethoxy)ethoxy]ethylamino]-(cyclopropylmethyl)BLAHdiol [2-[2-(2-aminoethoxy)ethoxy]ethy…
| 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) | 0.54 | 2.56 | -167.26 | 8 | 8 | 3 | 117 | 476.638 | 11 | ↓ |
| Hi High (pH 8-9.5) | 0.54 | 1.22 | -87.85 | 7 | 8 | 2 | 112 | 475.63 | 11 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50512-1-O | Cavia Porcellus (cluster #1 Of 7), Other | Other | 21 | 0.32 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50512 | Z50512 | Cavia Porcellus | 123 | 0.28 | Functional ≤ 10μM |
