| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2009 | 38 | 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) | 4.36 | 10.3 | -53.77 | 0 | 8 | -1 | 91 | 521.634 | 11 | ↓ |
| Mid Mid (pH 6-8) | 4.36 | 12.64 | -70.8 | 1 | 8 | 0 | 93 | 522.642 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 4.36 | 11.34 | -59.14 | 2 | 8 | 1 | 90 | 523.65 | 11 | ↓ |
