| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 23 | Yes |
Popular Name: 1-[(2S)-2-tert-butylazepan-1-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-one 1-[(2S)-2-tert-butylazepan-1-yl]…
| 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) | 3.91 | 9.95 | -7.95 | 0 | 4 | 0 | 38 | 319.493 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.91 | 10.08 | -30.93 | 1 | 4 | 1 | 39 | 320.501 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
