| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2009 | 43 | No |
Popular Name: [acetoxy-hydroxy-(isobutoxymethyl)-trimethyl-oxo-(3-pyridyl)BLAHyl] [acetoxy-hydroxy-(isobutoxymethy…
| 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) | 4.68 | 13.26 | -21.76 | 1 | 10 | 0 | 134 | 597.705 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.68 | 13.7 | -54.84 | 2 | 10 | 1 | 136 | 598.713 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
