| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2009 | 20 | Yes |
Popular Name: 3-(tert-butylamino)-1-[(2S)-2-(3-pyridyl)pyrrolidin-1-yl]propan-1-one 3-(tert-butylamino)-1-[(2S)-2-(3…
| 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) | 1.65 | 6.99 | -43.1 | 2 | 4 | 1 | 50 | 276.404 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.65 | 7.45 | -83.1 | 3 | 4 | 2 | 51 | 277.412 | 5 | ↓ |
