In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2011 | 21 | Yes |
Popular Name: N-[(1R)-1-[3-bromo-4-[(1-methyl-4-piperidyl)oxy]phenyl]ethyl]propan-1-amine N-[(1R)-1-[3-bromo-4-[(1-methyl-…
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) | 3.42 | 9.92 | -90.82 | 3 | 3 | 2 | 30 | 357.336 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.42 | 7.53 | -43.29 | 2 | 3 | 1 | 29 | 356.328 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.