| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: (1S,2R)-2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]indan-1-ol (1S,2R)-2-[(3S)-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) | 1.28 | 4.55 | -33.24 | 2 | 3 | 1 | 28 | 247.362 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.28 | 2.28 | -4.17 | 1 | 3 | 0 | 27 | 246.354 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.28 | 4.68 | -36.29 | 2 | 3 | 1 | 28 | 247.362 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.28 | 6.95 | -105.31 | 3 | 3 | 2 | 29 | 248.37 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
