In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 18 | Yes |
Popular Name: (4-ethyl-4-methyl-1-piperidyl)-[(2S,6S)-6-methyl-2-piperidyl]methanone (4-ethyl-4-methyl-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) | 2.57 | 6.68 | -33.9 | 2 | 3 | 1 | 37 | 253.41 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.57 | 5.5 | -6.97 | 1 | 3 | 0 | 32 | 252.402 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.