In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 21 | Yes |
Popular Name: 2-[4-[[(1S)-1-(4-hydroxyphenyl)propyl]amino]-1-piperidyl]acetamide 2-[4-[[(1S)-1-(4-hydroxyphenyl)p…
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) | 0.33 | 2.9 | -110.06 | 6 | 5 | 2 | 84 | 293.411 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.33 | 0.72 | -43.55 | 5 | 5 | 1 | 83 | 292.403 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.33 | 2.04 | -41.43 | 5 | 5 | 1 | 80 | 292.403 | 6 | ↓ |