| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2009 | 28 | Yes |
Popular Name: [(1S)-1,3-dihydroxy-3-methyl-butyl]-hydroxy-methoxy-methyl-BLAHone [(1S)-1,3-dihydroxy-3-methyl-but…
| 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) | 2.76 | 3.68 | -18.54 | 3 | 7 | 0 | 105 | 388.416 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 4.59 | -57.73 | 2 | 7 | -1 | 108 | 387.408 | 4 | ↓ |
