| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | Yes |
Popular Name: N,N-dimethyl-2-[4-[[(3R)-2-oxoazepan-3-yl]amino]-1-piperidyl]acetamide N,N-dimethyl-2-[4-[[(3R)-2-oxoaz…
| 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) | -0.57 | 4.52 | -112.51 | 4 | 6 | 2 | 70 | 298.431 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.57 | 2.16 | -11.9 | 2 | 6 | 0 | 65 | 296.415 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.57 | 4.36 | -45.33 | 3 | 6 | 1 | 66 | 297.423 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.57 | 2.35 | -44.4 | 3 | 6 | 1 | 69 | 297.423 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
