| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 4th, 2007 | 37 | 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) | 3.09 | 5.91 | -66.1 | 0 | 9 | -1 | 101 | 509.579 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.54 | 8.27 | -48.47 | 2 | 9 | 1 | 99 | 511.595 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | 8.24 | -79.5 | 1 | 9 | 0 | 102 | 510.587 | 10 | ↓ |
