In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 21 | Yes |
Popular Name: 1-[4-[(5-bromo-2-fluoro-phenyl)methylamino]-1-piperidyl]-2-methyl-propan-1-one 1-[4-[(5-bromo-2-fluoro-phenyl)m…
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) | 3.26 | 8.41 | -49.82 | 2 | 3 | 1 | 37 | 358.275 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.26 | 7.22 | -7.99 | 1 | 3 | 0 | 32 | 357.267 | 4 | ↓ |