| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 20 | Yes |
Popular Name: (2R)-1-[[1-[(1S)-1-methylpropyl]pyrazol-3-yl]methyl]azepane-2-carboxylic (2R)-1-[[1-[(1S)-1-methylpropyl]…
| 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) | 0.86 | 9.03 | -26.61 | 1 | 5 | 0 | 62 | 279.384 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 7.11 | -52.27 | 0 | 5 | -1 | 61 | 278.376 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
