In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 13 | Yes |
Popular Name: 2-[(3R)-3-(aminomethyl)-1-piperidyl]-N,N-dimethyl-ethanamine 2-[(3R)-3-(aminomethyl)-1-piperi…
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) | -0.05 | -0.11 | -43.53 | 3 | 3 | 1 | 34 | 186.323 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.05 | 2.21 | -102.07 | 4 | 3 | 2 | 35 | 187.331 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.05 | 4.72 | -185.41 | 5 | 3 | 3 | 37 | 188.339 | 4 | ↓ |