| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 4th, 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) | 3.37 | 9.47 | -52.47 | 0 | 10 | -1 | 128 | 508.551 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.78 | 12.06 | -58.55 | 1 | 10 | 1 | 123 | 510.567 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.81 | 11.11 | -50.77 | 2 | 10 | 1 | 126 | 510.567 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.37 | 11.81 | -71.17 | 1 | 10 | 0 | 129 | 509.559 | 10 | ↓ |
