| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 4th, 2010 | 29 | 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) | 3.34 | 12.35 | -16.59 | 0 | 7 | 0 | 71 | 390.443 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 12.58 | -12.07 | 1 | 7 | 0 | 70 | 390.443 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.34 | 12.88 | -15.99 | 1 | 7 | 0 | 72 | 391.451 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
