| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 31 | 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) | 2.13 | 8.18 | -17.84 | 4 | 9 | 0 | 118 | 419.489 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | 8.81 | -29.36 | 5 | 9 | 1 | 120 | 420.497 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | 7.82 | -30.73 | 5 | 9 | 1 | 120 | 420.497 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.13 | 9.22 | -79.91 | 6 | 9 | 2 | 121 | 421.505 | 7 | ↓ |
