In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 3rd, 2009 | 23 | Yes |
Popular Name: (2S)-1-ethyl-2-[[4-(4-methylphenoxy)-1-piperidyl]methyl]piperidine (2S)-1-ethyl-2-[[4-(4-methylphen…
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) | 3.43 | 12.19 | -31.42 | 1 | 3 | 1 | 17 | 317.497 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.43 | 9.57 | -2.75 | 0 | 3 | 0 | 16 | 316.489 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.43 | 12.21 | -112.53 | 2 | 3 | 2 | 18 | 318.505 | 5 | ↓ |