| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2009 | 30 | 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) | 0.99 | 5.04 | -86.98 | 4 | 8 | 0 | 111 | 421.448 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.98 | 6.26 | -55.6 | 3 | 8 | -1 | 107 | 420.44 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.98 | 9.55 | -168.22 | 5 | 8 | 1 | 112 | 422.456 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.98 | 6.32 | -46.18 | 5 | 8 | 1 | 105 | 422.456 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.99 | 5.89 | -86.32 | 4 | 8 | 0 | 108 | 421.448 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.98 | 7.55 | -134.18 | 6 | 8 | 2 | 110 | 423.464 | 5 | ↓ |
