| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 16 | Yes |
Popular Name: 4-(aminomethyl)-N-butyl-N-ethyl-1-methyl-piperidin-4-amine 4-(aminomethyl)-N-butyl-N-ethyl-…
| 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) | 1.45 | 3.54 | -30.19 | 3 | 3 | 1 | 34 | 228.404 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 3.8 | -114.22 | 4 | 3 | 2 | 35 | 229.412 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 6.13 | -92.23 | 4 | 3 | 2 | 35 | 229.412 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 3.86 | -32.43 | 3 | 3 | 1 | 34 | 228.404 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 4.3 | -108.23 | 4 | 3 | 2 | 35 | 229.412 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.45 | 6.15 | -212.14 | 5 | 3 | 3 | 37 | 230.42 | 6 | ↓ |
