| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 12th, 2007 | 31 | 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) | 1.70 | 6.47 | -18.02 | 3 | 11 | 0 | 136 | 430.465 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.70 | 7.23 | -55.53 | 2 | 11 | -1 | 139 | 429.457 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.69 | -3.8 | -37.68 | 4 | 11 | 1 | 137 | 431.473 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.70 | 6.87 | -51.97 | 4 | 11 | 1 | 138 | 431.473 | 8 | ↓ |
