| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 16 | Yes |
Popular Name: (3S)-1-[(1R,2S)-2-aminocycloheptyl]-N,N-dimethyl-pyrrolidin-3-amine (3S)-1-[(1R,2S)-2-aminocyclohept…
| 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) | 1.26 | 3.77 | -33.56 | 3 | 3 | 1 | 34 | 226.388 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.26 | 1.45 | -39.43 | 3 | 3 | 1 | 34 | 226.388 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.26 | 3.84 | -90.25 | 4 | 3 | 2 | 35 | 227.396 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
