| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 11th, 2009 | 13 | Yes |
Popular Name: 2,3-dihydroxychromen-4-one 2,3-dihydroxychromen-4-one
| 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) | 1.43 | 2.83 | -46.43 | 1 | 4 | -1 | 73 | 177.135 | 0 | ↓ |
| Ref Reference (pH 7) | 1.43 | 2.71 | -47.53 | 1 | 4 | -1 | 73 | 177.135 | 0 | ↓ |
| Hi High (pH 8-9.5) | 1.43 | 3.67 | -155.35 | 0 | 4 | -2 | 76 | 176.127 | 0 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | 1.6 | -19 | 2 | 4 | 0 | 71 | 178.143 | 0 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | 1.94 | -8.61 | 2 | 4 | 0 | 71 | 178.143 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0820057A1; EP1035428A2; US5879772 | IBM Patent Data |
| PUBCHEM_PATENT_ID | WO1996031206A2; WO1998013344A1 | IBM Patent Data |
