| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2004 | 29 | No |
| 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) | 4.88 | 12.48 | -108.34 | 0 | 4 | -2 | 80 | 435.347 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.88 | 11.33 | -38.36 | 1 | 4 | -1 | 77 | 436.355 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.29 | 13.14 | -36.52 | 0 | 4 | -1 | 74 | 436.355 | 3 | ↓ |
