| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 18 | Yes |
Popular Name: (1R)-1-[3-chloro-4-[(2R,4S)-2,4-dimethyl-1-piperidyl]phenyl]ethanamine (1R)-1-[3-chloro-4-[(2R,4S)-2,4-…
| 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) | 1.99 | 7.83 | -43.83 | 3 | 2 | 1 | 31 | 267.824 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 7.53 | -1.89 | 2 | 2 | 0 | 29 | 266.816 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
