| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 21 | Yes |
Popular Name: (2S)-2-(1,4-diazepan-1-yl)-2-(3-propoxyphenyl)acetamide (2S)-2-(1,4-diazepan-1-yl)-2-(3-…
| 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) | 1.13 | 2.69 | -43.09 | 4 | 5 | 1 | 72 | 292.403 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.13 | 1.49 | -7.3 | 3 | 5 | 0 | 68 | 291.395 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
