| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 10th, 2009 | 32 | No |
Popular Name: Methacycline Hydrochloride Methacycline Hydrochloride
Find On: PubMed — Wikipedia — Google
CAS Number: 3963-45-9
| 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) | -1.02 | 0.03 | -53.99 | 7 | 10 | 0 | 186 | 442.424 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.02 | -1.05 | -111.12 | 5 | 10 | -2 | 187 | 440.408 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.75 | -1.14 | -151.1 | 5 | 10 | -2 | 187 | 440.408 | 1 | ↓ |
| Hi High (pH 8-9.5) | -1.02 | -0.27 | -244.52 | 4 | 10 | -3 | 190 | 439.4 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.75 | -2.16 | -64.54 | 6 | 10 | -1 | 184 | 441.416 | 1 | ↓ |
| Hi High (pH 8-9.5) | -1.75 | -1.23 | -155.53 | 5 | 10 | -2 | 187 | 440.408 | 1 | ↓ |
| Mid Mid (pH 6-8) | -1.75 | -0.34 | -63.41 | 7 | 10 | 0 | 186 | 442.424 | 1 | ↓ |
| Mid Mid (pH 6-8) | -1.02 | 0.97 | -122.74 | 6 | 10 | -1 | 188 | 441.416 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.02 | -1.26 | -143.83 | 5 | 10 | -2 | 187 | 440.408 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.60 | 2.21 | -65.89 | 6 | 10 | 0 | 182 | 442.424 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.02 | -2.01 | -53.02 | 6 | 10 | -1 | 184 | 441.416 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Molecular_Solubility | 3.122 | Bitter DB |
No pre-computed analogs available. Try a structural similarity search.