| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 37 | 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) | 3.50 | 17.1 | -43.93 | 1 | 6 | 0 | 65 | 504.65 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.50 | 17.63 | -58.83 | 2 | 6 | 1 | 66 | 505.658 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.50 | 16.62 | -67.74 | 1 | 6 | 0 | 65 | 504.65 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.50 | 17.11 | -102.02 | 2 | 6 | 1 | 66 | 505.658 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.50 | 19.49 | -140.56 | 3 | 6 | 2 | 68 | 506.666 | 8 | ↓ |
