| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 21 | No |
Popular Name: 1-isopropyl-N-[(1R)-1-(4-nitrophenyl)ethyl]piperidin-4-amine 1-isopropyl-N-[(1R)-1-(4-nitroph…
| 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) | 3.11 | 9.06 | -40.46 | 2 | 5 | 1 | 62 | 292.403 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.11 | 7.8 | -52.58 | 2 | 5 | 1 | 66 | 292.403 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.11 | 10.01 | -123.78 | 3 | 5 | 2 | 67 | 293.411 | 5 | ↓ |
