In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2011 | 17 | Yes |
Popular Name: (2R,5R)-2-isopropyl-5-methyl-1-(1-methyl-4-piperidyl)piperazine (2R,5R)-2-isopropyl-5-methyl-1-(…
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) | 1.85 | 5.75 | -86.26 | 3 | 3 | 2 | 24 | 241.423 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.85 | 4.5 | -34.47 | 2 | 3 | 1 | 20 | 240.415 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.