In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 16 | Yes |
Popular Name: N-[(5-bromo-2-pyridyl)methyl]-1-methyl-piperidin-4-amine N-[(5-bromo-2-pyridyl)methyl]-1-…
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) | 1.73 | 5.08 | -35.27 | 2 | 3 | 1 | 29 | 285.209 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.73 | 6.26 | -106.23 | 3 | 3 | 2 | 34 | 286.217 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.