| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 4th, 2008 | 31 | 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) | 2.78 | 7.77 | -15.21 | 2 | 8 | 0 | 102 | 426.517 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.24 | 5.49 | -50.26 | 1 | 8 | -1 | 105 | 425.509 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.78 | 8.06 | -33.4 | 3 | 8 | 1 | 103 | 427.525 | 10 | ↓ |
