| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2014 | 38 | Yes |
Popular Name: Daunorubicin hydrochloride Daunorubicin hydrochloride
Find On: PubMed — Wikipedia — Google
CAS Numbers: 23541-50-6 , [23541-50-6]
| 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) | -1.86 | 5.41 | -60.09 | 4 | 10 | 0 | 167 | 529.586 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.28 | 6.06 | -138.51 | 3 | 10 | -2 | 171 | 527.57 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.28 | 5.92 | -130.06 | 4 | 10 | -1 | 173 | 528.578 | 4 | ↓ |
| Mid Mid (pH 6-8) | -1.86 | 5.33 | -62.78 | 4 | 10 | 0 | 167 | 529.586 | 4 | ↓ |
| Mid Mid (pH 6-8) | -2.45 | 5.83 | -54.47 | 4 | 10 | 1 | 161 | 530.594 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.