| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 35 | 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) | 3.74 | 11.61 | -38.63 | 0 | 7 | -1 | 92 | 491.951 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.16 | 10.24 | -24.5 | 0 | 7 | 0 | 86 | 492.959 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.19 | 9.26 | -27.3 | 1 | 7 | 0 | 89 | 492.959 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.19 | 9.56 | -54.62 | 2 | 7 | 1 | 90 | 493.967 | 8 | ↓ |
