| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 23 | 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) | 2.18 | 5.12 | -39.68 | 0 | 5 | -1 | 70 | 328.417 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | 6.11 | -48.31 | 1 | 5 | 0 | 72 | 329.425 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.72 | 7.88 | -42.84 | 2 | 5 | 1 | 69 | 330.433 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.72 | 6.89 | -7.52 | 1 | 5 | 0 | 67 | 329.425 | 4 | ↓ |
