| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2010 | 21 | Yes |
Popular Name: N-ethyl-N-(3-fluorophenyl)-6-[(isopropylamino)methyl]pyridin-2-amine N-ethyl-N-(3-fluorophenyl)-6-[(i…
| 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) | 3.66 | 8.68 | -7.4 | 1 | 3 | 0 | 28 | 287.382 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.66 | 9.86 | -34.31 | 2 | 3 | 1 | 33 | 288.39 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.66 | 9.54 | -105.04 | 3 | 3 | 2 | 34 | 289.398 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.66 | 8.32 | -27.99 | 2 | 3 | 1 | 29 | 288.39 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
