| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2010 | 21 | Yes |
Popular Name: N-[(1S)-1-(2-pyridyl)-2-(2,4,6-trimethylphenyl)ethyl]propan-1-amine N-[(1S)-1-(2-pyridyl)-2-(2,4,6-t…
| 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) | 4.39 | 10.43 | -34.42 | 2 | 2 | 1 | 29 | 283.439 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.39 | 9.73 | -3.8 | 1 | 2 | 0 | 25 | 282.431 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.39 | 10.12 | -31.93 | 2 | 2 | 1 | 26 | 283.439 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
