| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 17 | Yes |
Popular Name: 4-(aminomethyl)-N-butyl-N,1-diethyl-piperidin-4-amine 4-(aminomethyl)-N-butyl-N,1-diet…
| 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) | 1.83 | 4.35 | -30.12 | 3 | 3 | 1 | 34 | 242.431 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.83 | 6.78 | -92.13 | 4 | 3 | 2 | 35 | 243.439 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.83 | 4.53 | -31.2 | 3 | 3 | 1 | 34 | 242.431 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.83 | 4.97 | -108.94 | 4 | 3 | 2 | 35 | 243.439 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.83 | 4.61 | -114.89 | 4 | 3 | 2 | 35 | 243.439 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.83 | 6.82 | -214.45 | 5 | 3 | 3 | 37 | 244.447 | 7 | ↓ |
