| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2009 | 32 | No |
Popular Name: Methacycline Methacycline
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) | -1.60 | -0.2 | -25.12 | 5 | 10 | 0 | 181 | 441.416 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.75 | -2.42 | -69.76 | 6 | 10 | -1 | 184 | 441.416 | 1 | ↓ |
| Mid Mid (pH 6-8) | -1.75 | -0.55 | -73.44 | 7 | 10 | 0 | 186 | 442.424 | 1 | ↓ |
| Mid Mid (pH 6-8) | -2.34 | -1.18 | -23.63 | 6 | 10 | 0 | 178 | 442.424 | 1 | ↓ |
| Mid Mid (pH 6-8) | -1.60 | 1.48 | -60.95 | 6 | 10 | 0 | 182 | 442.424 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.60 | 2.12 | -76.25 | 5 | 10 | -1 | 185 | 441.416 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -2.34 | 0.47 | -54.19 | 7 | 10 | 1 | 180 | 443.432 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Molecular_Solubility | 3.122 | Bitter DB |
| ALOGPS_SOLUBILITY | 7.32e-01 g/l | DrugBank-approved |
| PUBCHEM_PATENT_ID | EP0025495A1; EP0027258A1; EP0034347A2; EP0056992A1; EP0064040A1; EP0091964A1; EP0091964B2; EP0110955A1; EP0110955B1; EP0126145A1; EP0126145B1; EP0129284A2; EP0129285A2; EP0129285B1; EP0131369A2; EP0137661A2; EP0178624A2; EP0182635A1; EP0201057A2; EP020105 | IBM Patent Data |
