| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 21 | Yes |
Popular Name: 2-[4-[(1R,2S,5S)-2-(aminomethyl)-5-tert-butyl-cyclohexyl]piperazin-1-yl]ethanol 2-[4-[(1R,2S,5S)-2-(aminomethyl)…
| 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) | 1.51 | 2.53 | -109.74 | 5 | 4 | 2 | 56 | 299.503 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.51 | 1.1 | -48.95 | 4 | 4 | 1 | 54 | 298.495 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
