| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 17 | Yes |
Popular Name: N-[(4,5-dimethyloxazol-2-yl)methyl]-2-(1-piperidyl)ethanamine N-[(4,5-dimethyloxazol-2-yl)meth…
| 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) | 1.40 | 4.52 | -116.97 | 3 | 4 | 2 | 47 | 239.363 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.40 | 3.15 | -36.83 | 2 | 4 | 1 | 42 | 238.355 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 2.31 | -40.93 | 2 | 4 | 1 | 46 | 238.355 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
