| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 17 | Yes |
Popular Name: [(1R,2S)-2-aminocyclohexyl]-(4-ethylpiperazin-1-yl)methanone [(1R,2S)-2-aminocyclohexyl]-(4-e…
| 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) | 0.58 | 2.31 | -40.32 | 3 | 4 | 1 | 51 | 240.371 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.58 | 4.52 | -95.02 | 4 | 4 | 2 | 52 | 241.379 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
