| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 29 | Yes |
None
| 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) | 1.67 | 6.16 | -15.14 | 2 | 7 | 0 | 95 | 383.411 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.67 | 6.93 | -54.63 | 1 | 7 | -1 | 98 | 382.403 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.67 | 5.63 | -46.39 | 3 | 7 | 1 | 96 | 384.419 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.67 | 5.93 | -114.02 | 4 | 7 | 2 | 97 | 385.427 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.47 | 4.04 | -36.99 | 2 | 7 | 1 | 92 | 384.419 | 4 | ↓ |
