| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2004 | 35 | 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) | 4.70 | 11.35 | -67.42 | 0 | 7 | -1 | 95 | 484.557 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.14 | 9.77 | -30.11 | 1 | 7 | 0 | 93 | 485.565 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.11 | 10.79 | -18.95 | 0 | 7 | 0 | 89 | 485.565 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.14 | 10.01 | -66.99 | 2 | 7 | 1 | 94 | 486.573 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.11 | 11.02 | -53.18 | 1 | 7 | 1 | 91 | 486.573 | 6 | ↓ |
