| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 17 | Yes |
Popular Name: (3S,4R)-3-(4,4-diethyl-1-piperidyl)tetrahydropyran-4-amine (3S,4R)-3-(4,4-diethyl-1-piperid…
| 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) | 1.54 | 4.44 | -123.5 | 4 | 3 | 2 | 41 | 242.407 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.54 | 1.76 | -1.68 | 2 | 3 | 0 | 38 | 240.391 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.54 | 2.43 | -41.52 | 3 | 3 | 1 | 40 | 241.399 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.54 | 4.07 | -30.19 | 3 | 3 | 1 | 40 | 241.399 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
