| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 7th, 2007 | 29 | 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) | 3.03 | 10.4 | -30.11 | 2 | 7 | 0 | 88 | 426.571 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.32 | -4.01 | -53.97 | 2 | 7 | 1 | 88 | 427.579 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.32 | -3.79 | -95.08 | 3 | 7 | 2 | 89 | 428.587 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 10.12 | -30.44 | 2 | 7 | 0 | 88 | 426.571 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 10.58 | -58.55 | 3 | 7 | 1 | 90 | 427.579 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 10.4 | -31.26 | 2 | 7 | 0 | 88 | 426.571 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 10.86 | -61.71 | 3 | 7 | 1 | 90 | 427.579 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 10.12 | -31.04 | 2 | 7 | 0 | 88 | 426.571 | 7 | ↓ |
