| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 10th, 2010 | 14 | Yes |
| 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) | 1.55 | 7.57 | -127.17 | 0 | 4 | -2 | 80 | 196.202 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 5.42 | -51.96 | 1 | 4 | -1 | 77 | 197.21 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 5.64 | -43.35 | 1 | 4 | -1 | 77 | 197.21 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4292151 | IBM Patent Data |
