| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2011 | 17 | Yes |
Popular Name: N,N-dimethyl-1-[(2R)-1-[[(3S)-3-methyl-3-piperidyl]methyl]pyrrolidin-2-yl]methanamine N,N-dimethyl-1-[(2R)-1-[[(3S)-3-…
| 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) | 1.21 | 5.81 | -87.39 | 3 | 3 | 2 | 24 | 241.423 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.21 | 5.75 | -90.15 | 3 | 3 | 2 | 24 | 241.423 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.21 | 3.49 | -37.26 | 2 | 3 | 1 | 23 | 240.415 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.21 | 7.93 | -185.92 | 4 | 3 | 3 | 25 | 242.431 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
