| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 30th, 2010 | 38 | 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) | -5.83 | -15.51 | -430.04 | 21 | 16 | 5 | 305 | 557.666 | 10 | ↓ |
| Hi High (pH 8-9.5) | -5.83 | -16.45 | -107.16 | 18 | 16 | 2 | 301 | 554.642 | 10 | ↓ |
| Hi High (pH 8-9.5) | -5.83 | -16.14 | -191.1 | 19 | 16 | 3 | 302 | 555.65 | 10 | ↓ |
| Hi High (pH 8-9.5) | -5.83 | -16.3 | -185.65 | 19 | 16 | 3 | 302 | 555.65 | 10 | ↓ |
| Mid Mid (pH 6-8) | -5.83 | -15.95 | -311.57 | 20 | 16 | 4 | 304 | 556.658 | 10 | ↓ |
