| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 15 | Yes |
Popular Name: 4-(aminomethyl)-N-butyl-N,1-dimethyl-piperidin-4-amine 4-(aminomethyl)-N-butyl-N,1-dime…
| 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) | 1.07 | 3.81 | -102.5 | 4 | 3 | 2 | 35 | 215.385 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.07 | 3.09 | -118.87 | 4 | 3 | 2 | 35 | 215.385 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.07 | 5 | -93.11 | 4 | 3 | 2 | 35 | 215.385 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.08 | 2.98 | -35.67 | 3 | 3 | 1 | 34 | 214.377 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.07 | 5.48 | -210.86 | 5 | 3 | 3 | 37 | 216.393 | 5 | ↓ |
