| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2008 | 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) | 0.68 | 6.27 | -81.76 | 3 | 9 | 0 | 130 | 427.457 | 9 | ↓ |
| Hi High (pH 8-9.5) | 0.68 | 3.74 | -66.08 | 2 | 9 | -1 | 129 | 426.449 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.09 | 6.88 | -63.77 | 3 | 9 | 1 | 124 | 428.465 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 6.19 | -54.91 | 4 | 9 | 1 | 128 | 428.465 | 9 | ↓ |
