| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 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) | 4.95 | 10.68 | -58.46 | 0 | 7 | -1 | 86 | 501.603 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.95 | 12.56 | -68.85 | 1 | 7 | 0 | 87 | 502.611 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.95 | 11.74 | -47.56 | 2 | 7 | 1 | 84 | 503.619 | 7 | ↓ |
