| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 17th, 2006 | 22 | No |
Popular Name: 5-bromo-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,3-dihydroxy-6-methoxy-benzamide 5-bromo-N-[(1-ethylpyrrolidin-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) | 1.91 | 2.39 | -41.27 | 4 | 6 | 1 | 83 | 374.255 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.91 | 3.31 | -57.76 | 3 | 6 | 0 | 86 | 373.247 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.91 | 3.31 | -53.76 | 3 | 6 | 0 | 86 | 373.247 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5240957 | IBM Patent Data |
