In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 21 | Yes |
Popular Name: (2R)-2-[(3S,5S)-3,5-dimethyl-1-piperidyl]-2-(4-propoxyphenyl)ethanamine (2R)-2-[(3S,5S)-3,5-dimethyl-1-p…
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) | 3.29 | 8.43 | -121.24 | 4 | 3 | 2 | 41 | 292.467 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.29 | 6.65 | -47.7 | 3 | 3 | 1 | 40 | 291.459 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.