In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2011 | 21 | Yes |
Popular Name: (2R)-3-(4-benzyl-1-piperidyl)-2-(cyclopropylamino)propan-1-ol (2R)-3-(4-benzyl-1-piperidyl)-2-…
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) | 2.42 | 8.03 | -111.6 | 4 | 3 | 2 | 41 | 290.451 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.42 | 5.14 | -3.54 | 2 | 3 | 0 | 35 | 288.435 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.42 | 6.14 | -32.09 | 3 | 3 | 1 | 40 | 289.443 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.42 | 6.82 | -36.21 | 3 | 3 | 1 | 37 | 289.443 | 7 | ↓ |