In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 16 | Yes |
Popular Name: N-[[1-(2-dimethylaminoethyl)-4-piperidyl]methyl]propan-1-amine N-[[1-(2-dimethylaminoethyl)-4-p…
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) | 1.46 | 8.11 | -179.42 | 4 | 3 | 3 | 25 | 230.42 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.46 | 3.4 | -38.67 | 2 | 3 | 1 | 23 | 228.404 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.46 | 5.87 | -81 | 3 | 3 | 2 | 24 | 229.412 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.46 | 5.64 | -95.91 | 3 | 3 | 2 | 24 | 229.412 | 7 | ↓ |