| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 16 | Yes |
Popular Name: N-[[(3R)-1-(2-dimethylaminoethyl)-3-piperidyl]methyl]cyclopropanamine N-[[(3R)-1-(2-dimethylaminoethyl…
| 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) | 1.30 | 3.33 | -36.08 | 2 | 3 | 1 | 23 | 226.388 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.30 | 5.81 | -80.43 | 3 | 3 | 2 | 24 | 227.396 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.30 | 5.55 | -96.9 | 3 | 3 | 2 | 24 | 227.396 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.30 | 8.04 | -182.55 | 4 | 3 | 3 | 25 | 228.404 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
