| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 21 | Yes |
Popular Name: (2R)-2-(1,4-diazepan-1-yl)-2-(4-propoxyphenyl)acetic (2R)-2-(1,4-diazepan-1-yl)-2-(4-…
| 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) | 1.67 | 6.95 | -27.92 | 2 | 5 | 0 | 66 | 292.379 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.67 | 6.41 | -62.12 | 2 | 5 | 0 | 69 | 292.379 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.67 | 8.25 | -88.95 | 3 | 5 | 1 | 70 | 293.387 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
