| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 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) | 5.40 | 10 | -33.24 | 2 | 5 | 1 | 65 | 409.457 | 4 | ↓ |
| Ref Reference (pH 7) | 5.40 | 9.51 | -37.35 | 2 | 5 | 1 | 65 | 409.457 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.40 | 9.14 | -17.35 | 1 | 5 | 0 | 63 | 408.449 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.40 | 8.66 | -14.15 | 1 | 5 | 0 | 63 | 408.449 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.