| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 25 | 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) | -0.07 | 2.85 | -51.58 | 3 | 10 | 1 | 140 | 361.363 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.13 | 1.21 | -59.91 | 1 | 10 | -1 | 142 | 359.347 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.07 | 2.33 | -27.45 | 2 | 10 | 0 | 138 | 360.355 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
