| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 24th, 2009 | 37 | 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) | -4.08 | 11.53 | -85.73 | 2 | 13 | -1 | 173 | 526.611 | 16 | ↓ |
| Hi High (pH 8-9.5) | -4.08 | 9.74 | -157.04 | 1 | 13 | -2 | 172 | 525.603 | 16 | ↓ |
| Lo Low (pH 4.5-6) | -4.08 | 13.53 | -161.04 | 3 | 13 | 0 | 174 | 527.619 | 16 | ↓ |
| Lo Low (pH 4.5-6) | -4.08 | 11.64 | -135.28 | 2 | 13 | -1 | 173 | 526.611 | 16 | ↓ |
