| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 19 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-(cyclohexylmethyl)-1-isopropyl-N-methyl-pyrrolidin-3-amine (3S)-3-(aminomethyl)-N-(cyclohex…
| 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) | 2.33 | 7.63 | -101.51 | 4 | 3 | 2 | 35 | 269.477 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 4.58 | -41.98 | 3 | 3 | 1 | 34 | 268.469 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 6.27 | -29.75 | 3 | 3 | 1 | 34 | 268.469 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.33 | 5.5 | -28.17 | 3 | 3 | 1 | 34 | 268.469 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.33 | 6.32 | -122.72 | 4 | 3 | 2 | 35 | 269.477 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.33 | 8.13 | -227.07 | 5 | 3 | 3 | 37 | 270.485 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.33 | 6.66 | -103.8 | 4 | 3 | 2 | 35 | 269.477 | 5 | ↓ |
