| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 28 | 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) | 1.02 | 3.36 | -36.92 | 6 | 9 | 1 | 131 | 391.496 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.02 | 3.42 | -15.56 | 5 | 9 | 0 | 129 | 390.488 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.02 | 5.64 | -80.44 | 7 | 9 | 2 | 132 | 392.504 | 6 | ↓ |
