In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 21 | Yes |
Popular Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-4-ethyl-5-methyl-thiophene-2-carboxamide N-[1-(2-amino-2-oxo-ethyl)-4-pip…
None
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) | 1.25 | 4.14 | -43.9 | 4 | 5 | 1 | 77 | 310.443 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.25 | 1.94 | -12.41 | 3 | 5 | 0 | 75 | 309.435 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.