In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2010 | 21 | Yes |
Popular Name: N-[2-(4-benzyl-1-piperidyl)ethyl]-2,2,2-trifluoro-ethanamine N-[2-(4-benzyl-1-piperidyl)ethyl…
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) | 3.28 | 8.73 | -40.25 | 2 | 2 | 1 | 16 | 301.376 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.28 | 6.49 | -3.57 | 1 | 2 | 0 | 15 | 300.368 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.