| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 18 | Yes |
Popular Name: (1R)-1-[3-bromo-4-[(2R,4R)-2,4-dimethyl-1-piperidyl]phenyl]ethanamine (1R)-1-[3-bromo-4-[(2R,4R)-2,4-d…
| 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) | 2.12 | 7.66 | -43.7 | 3 | 2 | 1 | 31 | 312.275 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.12 | 7.36 | -1.9 | 2 | 2 | 0 | 29 | 311.267 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
