| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 31st, 2007 | 37 | 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) | 3.00 | 7.92 | -49.88 | 0 | 9 | -1 | 101 | 509.579 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.42 | 10.64 | -47.95 | 1 | 9 | 1 | 96 | 511.595 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 10.25 | -61.16 | 1 | 9 | 0 | 102 | 510.587 | 10 | ↓ |
