In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 16 | Yes |
Popular Name: (5R)-5-[(5-bromo-2-pyridyl)methylamino]piperidin-2-one (5R)-5-[(5-bromo-2-pyridyl)methy…
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) | 0.80 | 2.44 | -55.78 | 3 | 4 | 1 | 59 | 285.165 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.80 | 1.27 | -10.01 | 2 | 4 | 0 | 54 | 284.157 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.