| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 18 | Yes |
Popular Name: 2-[[(1S)-2-(diethylamino)-1-methyl-ethyl]amino]pyridine-4-carboxylic 2-[[(1S)-2-(diethylamino)-1-meth…
| 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) | 2.05 | 6.45 | -78.58 | 1 | 5 | -1 | 71 | 250.322 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.87 | 5.17 | -47.43 | 1 | 5 | -1 | 68 | 250.322 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.87 | 7.34 | -62.1 | 2 | 5 | 0 | 69 | 251.33 | 7 | ↓ |
