| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 19th, 2010 | 36 | 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) | 2.99 | 10.01 | -17.05 | 1 | 9 | 0 | 89 | 503.481 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.99 | 10.48 | -41.36 | 2 | 9 | 1 | 90 | 504.489 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.99 | 12.76 | -105.09 | 3 | 9 | 2 | 91 | 505.497 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.99 | 12.29 | -45.04 | 2 | 9 | 1 | 90 | 504.489 | 8 | ↓ |
