| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 31st, 2006 | 24 | Yes |
Popular Name: Desmethoxycentaureidin Desmethoxycentaureidin
Find On: PubMed — Wikipedia — Google
CAS Number: [22934-99-2]
| 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) | 2.30 | 1.85 | -19.64 | 3 | 7 | 0 | 109 | 330.292 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 2.79 | -62.13 | 2 | 7 | -1 | 112 | 329.284 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 2.64 | -51.15 | 2 | 7 | -1 | 112 | 329.284 | 3 | ↓ |
