| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 20 | Yes |
Popular Name: N-ethyl-5-[[4-[(1R)-1-methylpropyl]piperazin-1-yl]methyl]pyridin-2-amine N-ethyl-5-[[4-[(1R)-1-methylprop…
| 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) | 2.18 | 6.74 | -76.07 | 3 | 4 | 2 | 34 | 278.444 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.18 | 4.35 | -3.88 | 1 | 4 | 0 | 31 | 276.428 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | 6.27 | -33.55 | 2 | 4 | 1 | 33 | 277.436 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
