In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 15 | Yes |
Popular Name: 2-[4-(aminomethyl)-1-piperidyl]-N,N-diethyl-ethanamine 2-[4-(aminomethyl)-1-piperidyl]-…
None
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) | 0.70 | 5.99 | -181.54 | 5 | 3 | 3 | 37 | 216.393 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.70 | 1.63 | -43.25 | 3 | 3 | 1 | 34 | 214.377 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.70 | 3.77 | -83.25 | 4 | 3 | 2 | 35 | 215.385 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.70 | 3.87 | -98.66 | 4 | 3 | 2 | 35 | 215.385 | 6 | ↓ |