In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 21 | Yes |
Popular Name: (2R)-2-(4-ethyl-4-methyl-1-piperidyl)-2-[5-[(1S,2S)-2-methylcyclopropyl]-2-furyl]ethanamine (2R)-2-(4-ethyl-4-methyl-1-piper…
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 | 8.85 | -118.81 | 4 | 3 | 2 | 45 | 292.467 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 7.08 | -44.31 | 3 | 3 | 1 | 44 | 291.459 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 8.48 | -32.23 | 3 | 3 | 1 | 44 | 291.459 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.