In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 19 | Yes |
Popular Name: (3R)-3-methyl-1-(2-piperazin-1-ylacetyl)piperidine-3-carboxylic (3R)-3-methyl-1-(2-piperazin-1-y…
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) | -0.75 | 3.69 | -80.18 | 2 | 6 | 0 | 80 | 269.345 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.75 | 2.33 | -54.24 | 1 | 6 | -1 | 76 | 268.337 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.