| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 32 | 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) | 0.95 | 7.18 | -60.29 | 0 | 8 | -1 | 105 | 430.44 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 6.8 | -17.12 | 1 | 8 | 0 | 102 | 431.448 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.40 | 7.11 | -42.7 | 2 | 8 | 1 | 103 | 432.456 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.40 | 7.11 | -44.44 | 2 | 8 | 1 | 103 | 432.456 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.40 | 7.42 | -114.99 | 3 | 8 | 2 | 104 | 433.464 | 6 | ↓ |
