| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2010 | 45 | 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) | 6.47 | 19.18 | -188.21 | 4 | 5 | 3 | 32 | 610.955 | 13 | ↓ |
| Hi High (pH 8-9.5) | 6.47 | 15.95 | -40.38 | 2 | 5 | 1 | 30 | 608.939 | 13 | ↓ |
| Hi High (pH 8-9.5) | 6.47 | 15.69 | -36.02 | 2 | 5 | 1 | 26 | 608.939 | 13 | ↓ |
| Mid Mid (pH 6-8) | 6.47 | 18.42 | -197.2 | 4 | 5 | 3 | 32 | 610.955 | 13 | ↓ |
| Mid Mid (pH 6-8) | 6.47 | 17.23 | -109.88 | 3 | 5 | 2 | 31 | 609.947 | 13 | ↓ |
