| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 24th, 2011 | 33 | Yes |
| 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) | -3.70 | -8.43 | -267.53 | 15 | 12 | 4 | 212 | 479.619 | 8 | ↓ |
| Hi High (pH 8-9.5) | -3.70 | -11.49 | -51.14 | 12 | 12 | 1 | 201 | 476.595 | 8 | ↓ |
| Hi High (pH 8-9.5) | -3.70 | -11.65 | -9.51 | 11 | 12 | 0 | 200 | 475.587 | 8 | ↓ |
| Hi High (pH 8-9.5) | -3.70 | -10.47 | -38.64 | 12 | 12 | 1 | 204 | 476.595 | 8 | ↓ |
| Mid Mid (pH 6-8) | -3.70 | -8.49 | -302.14 | 15 | 12 | 4 | 212 | 479.619 | 8 | ↓ |
| Mid Mid (pH 6-8) | -3.70 | -8.1 | -410.07 | 16 | 12 | 5 | 214 | 480.627 | 8 | ↓ |
