| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2014 | 45 | Yes |
Popular Name: Berbamine dihydrochloride Berbamine dihydrochloride
Find On: PubMed — Wikipedia — Google
CAS Numbers: 6078-17-7 , [6078-17-7]
| 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) | 6.24 | 7.79 | -13.42 | 1 | 8 | 0 | 73 | 608.735 | 3 | ↓ |
| Hi High (pH 8-9.5) | 6.24 | 8.62 | -62.73 | 0 | 8 | -1 | 76 | 607.727 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 6.24 | 14.59 | -100.8 | 3 | 8 | 2 | 75 | 610.751 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 6.24 | 11.28 | -48.08 | 2 | 8 | 1 | 74 | 609.743 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.