| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 17 | Yes |
Popular Name: [5-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-1,3-dimethyl-pyrazol-4-yl]methanol [5-[(3S)-3-(dimethylamino)pyrrol…
| 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) | 0.25 | 3.4 | -48.09 | 2 | 5 | 1 | 46 | 239.343 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.25 | 1 | -8.87 | 1 | 5 | 0 | 45 | 238.335 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.25 | 3.53 | -83.83 | 3 | 5 | 2 | 47 | 240.351 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
