| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 30 | 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) | 1.71 | 9.86 | -62.37 | 1 | 7 | 0 | 91 | 409.486 | 10 | ↓ |
| Mid Mid (pH 6-8) | 1.71 | 11.21 | -103.51 | 2 | 7 | 1 | 92 | 410.494 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 1.71 | 10.32 | -102.58 | 3 | 7 | 2 | 89 | 411.502 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 1.71 | 9.12 | -41.01 | 2 | 7 | 1 | 88 | 410.494 | 10 | ↓ |
