| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 24th, 2008 | 16 | No |
None
| 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) | 1.87 | 6.63 | -43.58 | 4 | 4 | 1 | 54 | 241.384 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.87 | 6.14 | -17.68 | 3 | 4 | 0 | 53 | 240.376 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.91 | 6.13 | -24.6 | 3 | 4 | 0 | 55 | 240.376 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.91 | 6.21 | -72.43 | 4 | 4 | 2 | 56 | 242.392 | 8 | ↓ |
