In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 25th, 2011 | 14 | Yes |
Popular Name: 1-[(2R)-1-(1-ethylpropyl)-2-piperidyl]-N-methyl-methanamine 1-[(2R)-1-(1-ethylpropyl)-2-pipe…
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) | 2.77 | 6.9 | -103.01 | 3 | 2 | 2 | 21 | 200.37 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 5.03 | -38.42 | 2 | 2 | 1 | 20 | 199.362 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.77 | 7.69 | -24.81 | 2 | 2 | 1 | 16 | 199.362 | 5 | ↓ |