| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 19th, 2010 | 33 | 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) | 4.24 | 7.73 | -22.65 | 1 | 8 | 0 | 96 | 491.683 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.05 | 7.01 | -50.29 | 0 | 8 | -1 | 102 | 490.675 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.05 | 9.29 | -48.04 | 1 | 8 | 0 | 103 | 491.683 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.24 | 9.88 | -60.31 | 2 | 8 | 1 | 97 | 492.691 | 8 | ↓ |
