| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 18 | 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) | 2.31 | 3.03 | -10.06 | 3 | 4 | 0 | 71 | 237.262 | 1 | ↓ |
| Ref Reference (pH 7) | 2.57 | 3.39 | -26.47 | 4 | 4 | 1 | 69 | 238.27 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.77 | 1.27 | -49.44 | 2 | 4 | -1 | 74 | 236.254 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.57 | 3.21 | -87.58 | 5 | 4 | 2 | 71 | 239.278 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.31 | 2.88 | -46.95 | 4 | 4 | 1 | 73 | 238.27 | 1 | ↓ |
