In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 20 | Yes |
Popular Name: (4-ethyl-4-piperidyl)-(4-isobutylpiperazin-1-yl)methanone (4-ethyl-4-piperidyl)-(4-isobuty…
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) | 1.46 | 6.85 | -98.55 | 3 | 4 | 2 | 41 | 283.46 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.46 | 4.9 | -41.58 | 2 | 4 | 1 | 40 | 282.452 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.