| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 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) | -0.77 | 4.53 | -14.04 | 0 | 9 | 0 | 102 | 254.213 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.77 | 5.59 | -63.11 | 1 | 9 | 1 | 104 | 255.221 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.77 | 5.79 | -164.21 | 2 | 9 | 2 | 105 | 256.229 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
