| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2011 | 20 | Yes |
| 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) | 1.81 | 7.2 | -38.76 | 2 | 4 | 1 | 41 | 294.444 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.81 | 5.51 | -8.23 | 1 | 4 | 0 | 40 | 293.436 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.81 | 7.53 | -82.87 | 3 | 4 | 2 | 42 | 295.452 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
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