| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2007 | 35 | 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) | 1.81 | 5.5 | -60.34 | 0 | 9 | -1 | 108 | 476.509 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.81 | 7.76 | -72.36 | 1 | 9 | 0 | 109 | 477.517 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.81 | 7.47 | -109.05 | 3 | 9 | 2 | 108 | 479.533 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.81 | 8.22 | -111.75 | 2 | 9 | 1 | 111 | 478.525 | 8 | ↓ |
