In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 15 | Yes |
Popular Name: [(3S)-3-methyl-3-piperidyl]-piperazin-1-yl-methanone [(3S)-3-methyl-3-piperidyl]-pipe…
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) | -0.59 | 2.13 | -108.13 | 4 | 4 | 2 | 54 | 213.325 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.59 | 0.92 | -33.97 | 3 | 4 | 1 | 49 | 212.317 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.