| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 20 | Yes |
Popular Name: [(1S,2R,3R)-2-amino-3-methyl-cyclohexyl]-[(3S)-3-pyrrolidin-1-ylpyrrolidin-1-yl]methanone [(1S,2R,3R)-2-amino-3-methyl-cyc…
| 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) | 1.10 | 6.17 | -84.71 | 4 | 4 | 2 | 52 | 281.444 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.10 | 3.76 | -37.5 | 3 | 4 | 1 | 51 | 280.436 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
