| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 23rd, 2014 | 16 | 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) | 0.02 | 0.44 | -33.91 | 0 | 6 | -1 | 77 | 214.208 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.02 | 1.43 | -8.61 | 1 | 6 | 0 | 75 | 215.216 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.02 | 1.82 | -41.26 | 2 | 6 | 1 | 76 | 216.224 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.