| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 19 | 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) | -0.08 | 0.23 | -61.36 | 3 | 5 | 1 | 74 | 291.437 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.08 | -0.11 | -9.42 | 2 | 5 | 0 | 73 | 290.429 | 7 | ↓ |
| Lo Low (pH 4.5-6) | -0.08 | 1.2 | -135.26 | 4 | 5 | 2 | 75 | 292.445 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
