In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 17 | Yes |
Popular Name: 4-ethyl-1-[[(2S,4S)-4-methoxypyrrolidin-2-yl]methyl]-4-methyl-piperidine 4-ethyl-1-[[(2S,4S)-4-methoxypyr…
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) | 2.11 | 5.05 | -32.14 | 2 | 3 | 1 | 26 | 241.399 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.11 | 6.18 | -117.61 | 3 | 3 | 2 | 30 | 242.407 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.