In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2011 | 23 | Yes |
Popular Name: (2S)-2-(3-acetylphenoxy)-N-[(1S)-1-(4-pyridyl)ethyl]propanamide (2S)-2-(3-acetylphenoxy)-N-[(1S)…
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) | 2.01 | 7.33 | -21.22 | 1 | 5 | 0 | 68 | 312.369 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.01 | 7.69 | -55.58 | 2 | 5 | 1 | 70 | 313.377 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.