In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 18 | Yes |
Popular Name: N2-(1-ethyl-4-piperidyl)-N2,3-dimethyl-pyridine-2,5-diamine N2-(1-ethyl-4-piperidyl)-N2,3-di…
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) | 1.97 | 7.18 | -77.3 | 4 | 4 | 2 | 48 | 250.39 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.97 | 6.71 | -35.46 | 3 | 4 | 1 | 47 | 249.382 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.