In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 19 | Yes |
Popular Name: 2-[(2S)-2-[2-(4-hydroxyphenyl)ethyl]-1-piperidyl]acetic 2-[(2S)-2-[2-(4-hydroxyphenyl)et…
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) | 1.41 | 7.4 | -34.54 | 2 | 4 | 0 | 65 | 263.337 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.41 | 6 | -50.11 | 1 | 4 | -1 | 64 | 262.329 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.