In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 16 | Yes |
Popular Name: [(2R)-1-[(4-chlorophenyl)methyl]-2-piperidyl]methanamine [(2R)-1-[(4-chlorophenyl)methyl]…
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) | 2.12 | 6.12 | -123.89 | 4 | 2 | 2 | 32 | 240.778 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.12 | 3.85 | -50.41 | 3 | 2 | 1 | 31 | 239.77 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.12 | 6.51 | -32.33 | 3 | 2 | 1 | 30 | 239.77 | 3 | ↓ |