| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2004 | 29 | 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) | 4.09 | 13.81 | -22.32 | 1 | 7 | 0 | 81 | 389.459 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.09 | 14.06 | -54.9 | 1 | 7 | -1 | 83 | 388.451 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.09 | 14.53 | -34.25 | 3 | 7 | 1 | 86 | 390.467 | 6 | ↓ |
