In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2008 | 21 | Yes |
Popular Name: 4-bromo-2-[(1S)-1-[(1-propyl-4-piperidyl)amino]propyl]phenol 4-bromo-2-[(1S)-1-[(1-propyl-4-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) | 3.68 | 7.56 | -34.44 | 3 | 3 | 1 | 37 | 356.328 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.68 | 6.61 | -38.5 | 2 | 3 | 0 | 43 | 355.32 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.68 | 5.82 | -37.47 | 3 | 3 | 1 | 40 | 356.328 | 6 | ↓ |