In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 19 | Yes |
Popular Name: (4-ethyl-4-piperidyl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone (4-ethyl-4-piperidyl)-[4-(2-hydr…
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) | -0.29 | -0.13 | -44.23 | 3 | 5 | 1 | 60 | 270.397 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.29 | 2.19 | -97.28 | 4 | 5 | 2 | 62 | 271.405 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.