| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 18 | Yes |
Popular Name: 4-(aminomethyl)-N-isopropyl-1-methyl-N-pentyl-piperidin-4-amine 4-(aminomethyl)-N-isopropyl-1-me…
| 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) | 2.25 | 4.56 | -27.2 | 3 | 3 | 1 | 34 | 256.458 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 4.51 | -117.06 | 4 | 3 | 2 | 35 | 257.466 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 7.12 | -94.05 | 4 | 3 | 2 | 35 | 257.466 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 5.17 | -34.85 | 3 | 3 | 1 | 34 | 256.458 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 5.34 | -104.04 | 4 | 3 | 2 | 35 | 257.466 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.25 | 6.92 | -213.09 | 5 | 3 | 3 | 37 | 258.474 | 7 | ↓ |
