| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 17 | Yes |
Popular Name: (1S,2R)-2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]cyclooctanol (1S,2R)-2-[(3R)-3-(dimethylamino…
| 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) | 2.26 | 3.28 | -30.18 | 2 | 3 | 1 | 28 | 241.399 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.26 | 5.69 | -102.31 | 3 | 3 | 2 | 29 | 242.407 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.26 | 3.34 | -35.37 | 2 | 3 | 1 | 28 | 241.399 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
