| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 19 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-cyclohexyl-N-ethyl-1-isopropyl-pyrrolidin-3-amine (3S)-3-(aminomethyl)-N-cyclohexy…
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|
| Hi High (pH 8-9.5) | 2.32 | 2.77 | -38.59 | 3 | 3 | 1 | 34 | 268.469 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.32 | 5.19 | -32.02 | 3 | 3 | 1 | 34 | 268.469 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.32 | 7.19 | -96.85 | 4 | 3 | 2 | 35 | 269.477 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.32 | 4.72 | -26.57 | 3 | 3 | 1 | 34 | 268.469 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.32 | 3.66 | -116.81 | 4 | 3 | 2 | 35 | 269.477 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.32 | 6.7 | -220.95 | 5 | 3 | 3 | 37 | 270.485 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.32 | 5.24 | -107.06 | 4 | 3 | 2 | 35 | 269.477 | 5 | ↓ |
