| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 27th, 2006 | 25 | 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) | 2.36 | 10.28 | -19.1 | 1 | 9 | 0 | 119 | 361.383 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 10.02 | -41.04 | 0 | 9 | -1 | 120 | 360.375 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.89 | 9.16 | -11.86 | 1 | 5 | 0 | 59 | 421.324 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.70 | 10.22 | -33.88 | 2 | 9 | 1 | 124 | 362.391 | 4 | ↓ |
