In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 19 | Yes |
Popular Name: N-[(4-bromo-2-fluoro-phenyl)methyl]-3-(1-piperidyl)propan-1-amine N-[(4-bromo-2-fluoro-phenyl)meth…
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) | 3.61 | 9.87 | -108.67 | 3 | 2 | 2 | 21 | 331.273 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.61 | 8.48 | -34.73 | 2 | 2 | 1 | 16 | 330.265 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 7.65 | -42.71 | 2 | 2 | 1 | 20 | 330.265 | 6 | ↓ |