| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 14th, 2011 | 28 | 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) | 2.30 | 10.29 | -49.4 | 1 | 5 | -1 | 94 | 387.496 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.30 | 8.3 | -14.98 | 2 | 5 | 0 | 92 | 388.504 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 157°C | Indofine |
No pre-computed analogs available. Try a structural similarity search.