| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 16 | Yes |
Popular Name: N,N-dimethyl-1-[(2R)-1-[(3S,6S)-6-methyl-3-piperidyl]pyrrolidin-2-yl]methanamine N,N-dimethyl-1-[(2R)-1-[(3S,6S)-…
| 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) | 1.27 | 4.43 | -90.53 | 3 | 3 | 2 | 24 | 227.396 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 2.09 | -36.75 | 2 | 3 | 1 | 23 | 226.388 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 2.89 | -35.95 | 2 | 3 | 1 | 20 | 226.388 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.27 | 6.21 | -203.18 | 4 | 3 | 3 | 25 | 228.404 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
