In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 20 | Yes |
Popular Name: (1S,2S,4R)-2-(4-methyl-1-piperidyl)-4-phenyl-cyclohexan-1-amine (1S,2S,4R)-2-(4-methyl-1-piperid…
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) | 3.08 | 9.33 | -123.67 | 4 | 2 | 2 | 32 | 274.452 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.08 | 7.86 | -49.68 | 3 | 2 | 1 | 31 | 273.444 | 2 | ↓ |