| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 21 | Yes |
Popular Name: 5-chloro-6-[[(3S)-3-(diethylamino)pyrrolidin-1-yl]methyl]-N-ethyl-pyridin-2-amine 5-chloro-6-[[(3S)-3-(diethylamin…
| 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) | 3.06 | 6.78 | -28.25 | 2 | 4 | 1 | 33 | 311.881 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.06 | 4.29 | -3.73 | 1 | 4 | 0 | 31 | 310.873 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.06 | 6.39 | -31.93 | 2 | 4 | 1 | 33 | 311.881 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.06 | 6.91 | -74.26 | 3 | 4 | 2 | 34 | 312.889 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
