| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 19 | No |
Popular Name: N-methyl-2-[1-(6-nitro-3-pyridyl)-4-piperidyl]ethanamine N-methyl-2-[1-(6-nitro-3-pyridyl…
| 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) | 2.28 | 7.27 | -53.16 | 2 | 6 | 1 | 79 | 265.337 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.28 | 7.67 | -89.39 | 3 | 6 | 2 | 80 | 266.345 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
