| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 17th, 2011 | 35 | 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) | 3.07 | 9.7 | -49.81 | 2 | 10 | 1 | 114 | 505.665 | 12 | ↓ |
| Hi High (pH 8-9.5) | 3.53 | 5.81 | -59.25 | 0 | 10 | -1 | 116 | 503.649 | 12 | ↓ |
| Mid Mid (pH 6-8) | 3.53 | 7.91 | -59.19 | 1 | 10 | 0 | 117 | 504.657 | 12 | ↓ |
