| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2004 | 31 | 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) | 3.32 | 7.41 | -56.98 | 1 | 7 | -1 | 94 | 415.473 | 5 | ↓ |
| Ref Reference (pH 7) | 3.32 | 7.52 | -55.6 | 1 | 7 | -1 | 94 | 415.473 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.32 | 7.52 | -63.87 | 2 | 7 | 0 | 95 | 416.481 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.32 | 7.62 | -64.33 | 2 | 7 | 0 | 95 | 416.481 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.86 | 10.05 | -70.21 | 3 | 7 | 0 | 92 | 417.489 | 5 | ↓ |
