| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 25th, 2008 | 27 | 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) | 1.16 | 5.48 | -42.17 | 4 | 7 | 1 | 91 | 368.461 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.16 | 4.99 | -14 | 3 | 7 | 0 | 90 | 367.453 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.16 | 5.04 | -15.21 | 3 | 7 | 0 | 90 | 367.453 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.16 | 6.12 | -56.04 | 4 | 7 | 1 | 95 | 368.461 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.16 | 6.65 | -114.89 | 5 | 7 | 2 | 96 | 369.469 | 3 | ↓ |
