| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 34 | 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) | 0.62 | 6.41 | -45.24 | 0 | 9 | -1 | 124 | 477.522 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.03 | -5.3 | -33.93 | 0 | 9 | 0 | 117 | 478.53 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | -5.57 | -40.76 | 1 | 9 | 0 | 120 | 478.53 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.06 | -5.46 | -66.68 | 2 | 9 | 1 | 122 | 479.538 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.06 | -5.46 | -82.63 | 2 | 9 | 1 | 122 | 479.538 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.06 | -5.35 | -124.14 | 3 | 9 | 2 | 123 | 480.546 | 6 | ↓ |
