| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 6th, 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) | 4.53 | 3.49 | -9.75 | 3 | 6 | 0 | 102 | 393.255 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.53 | 4.27 | -31.59 | 2 | 6 | -1 | 104 | 392.247 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
