| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 30 | 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) | 3.16 | 10.29 | -13.01 | 1 | 8 | 0 | 109 | 426.546 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.16 | 10.74 | -40.2 | 2 | 8 | 1 | 111 | 427.554 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.16 | 10.51 | -49.91 | 2 | 8 | 1 | 111 | 427.554 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.16 | 10.96 | -112.32 | 3 | 8 | 2 | 112 | 428.562 | 7 | ↓ |
