In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 20 | Yes |
Popular Name: (2R)-1-(4,4-diethyl-1-piperidyl)-2-piperazin-1-yl-propan-1-one (2R)-1-(4,4-diethyl-1-piperidyl)…
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) | 1.55 | 4.64 | -42.51 | 2 | 4 | 1 | 40 | 282.452 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.55 | 3.29 | -7.36 | 1 | 4 | 0 | 36 | 281.444 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.