| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 24th, 2011 | 4 | No |
Popular Name: Thionin acetate Thionin acetate
Find On: PubMed — Wikipedia — Google
CAS Number: 78338-22-4
| 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) | -0.13 | 1.39 | -37.32 | 0 | 2 | -1 | 40 | 77.084 | 0 | ↓ |
| Hi High (pH 8-9.5) | -0.13 | 1.92 | -118.29 | 0 | 2 | -2 | 40 | 76.076 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.55 | -1.16 | -36.53 | 1 | 2 | -1 | 43 | 77.084 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.