| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 17 | Yes |
Popular Name: (3R,4S)-3-[(3S)-3-(diethylamino)pyrrolidin-1-yl]tetrahydropyran-4-ol (3R,4S)-3-[(3S)-3-(diethylamino)…
| 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) | 0.70 | 1.54 | -31.67 | 2 | 4 | 1 | 37 | 243.371 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.70 | 1.27 | -34.72 | 2 | 4 | 1 | 37 | 243.371 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.70 | 3.67 | -102.1 | 3 | 4 | 2 | 38 | 244.379 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
