| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2009 | 32 | No |
Popular Name: Doxycycline Doxycycline
None
| 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) | -1.46 | 3 | -31.7 | 5 | 10 | 0 | 181 | 443.432 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.87 | 4.42 | -107.85 | 5 | 10 | 0 | 191 | 442.424 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.46 | 3.58 | -71.11 | 6 | 10 | 0 | 182 | 444.44 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.46 | 4.73 | -43.96 | 5 | 10 | 0 | 185 | 443.432 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.43 | 3.36 | -63.63 | 6 | 10 | 0 | 188 | 443.432 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.