| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2009 | 32 | 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) | 4.84 | 9.3 | -45.91 | 3 | 6 | 1 | 80 | 493.074 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.84 | 6.73 | -42.92 | 1 | 6 | -1 | 81 | 491.058 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.84 | 9.3 | -60.04 | 2 | 6 | 0 | 82 | 492.066 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.84 | 6.76 | -11.53 | 2 | 6 | 0 | 79 | 492.066 | 8 | ↓ |
