| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 17 | 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) | 2.27 | 6.56 | -15.23 | 1 | 3 | 0 | 42 | 243.335 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.18 | 6.35 | -8.58 | 2 | 3 | 0 | 44 | 243.335 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.18 | 6.76 | -22.23 | 3 | 3 | 1 | 45 | 244.343 | 2 | ↓ |
