| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 34 | No |
Popular Name: 9-Amino minocycline hydrochloride 9-Amino minocycline hydrochloride
Find On: PubMed — Wikipedia — Google
CAS Numbers: 149934-21-4 , [149934-21-4]
"9-Amino minocycline hydrochloride, 95% [epimer£¼1.2%]"
9-Amino-minocycline hydrochloride
9-Aminominocyclinehydrochloride
| 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 | 1.5 | -52.93 | 8 | 11 | 0 | 195 | 472.498 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.02 | 0.46 | -137.8 | 6 | 11 | -2 | 196 | 470.482 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.61 | -1.9 | -122.06 | 5 | 11 | -2 | 193 | 470.482 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.02 | 1.45 | -236.52 | 5 | 11 | -3 | 199 | 469.474 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.76 | -1.99 | -18.07 | 8 | 11 | 0 | 191 | 472.498 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.02 | 2.68 | -116.67 | 7 | 11 | -1 | 198 | 471.49 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.02 | -0.54 | -54.42 | 7 | 11 | -1 | 193 | 471.49 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.61 | 0.68 | -88.62 | 6 | 11 | -1 | 194 | 471.49 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.61 | 0.64 | -112.41 | 6 | 11 | -1 | 194 | 471.49 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -1.76 | -0.1 | -47.99 | 9 | 11 | 1 | 192 | 473.506 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 85+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_PATENT_ID | US5326759; US5401863; US5494903; US5529990 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.