| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 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) | 5.26 | 11.87 | -70.72 | 0 | 7 | -1 | 96 | 467.501 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.26 | 12.27 | -54.42 | 1 | 7 | 0 | 97 | 468.509 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.26 | 11.12 | -17.34 | 1 | 7 | 0 | 93 | 468.509 | 6 | ↓ |
