| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2011 | 21 | No |
Popular Name: 2-(2-chloro-5-nitro-phenoxy)-1-(1,4-diazepan-1-yl)ethanone 2-(2-chloro-5-nitro-phenoxy)-1-(…
| 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) | 1.48 | 7.53 | -51.09 | 2 | 7 | 1 | 92 | 314.749 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.48 | 6.17 | -12.27 | 1 | 7 | 0 | 87 | 313.741 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
