In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 21 | Yes |
Popular Name: (2S)-2-amino-3-(4-hydroxyphenyl)-N-[2-(1-piperidyl)ethyl]propanamide (2S)-2-amino-3-(4-hydroxyphenyl)…
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) | 0.55 | 2.73 | -102.55 | 6 | 5 | 2 | 81 | 293.411 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.55 | 2.41 | -44.68 | 5 | 5 | 1 | 80 | 292.403 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.