| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2009 | 21 | Yes |
Popular Name: 4-[[1-butyl-5-(hydroxymethyl)imidazol-2-yl]sulfanylmethyl]benzonitrile 4-[[1-butyl-5-(hydroxymethyl)imi…
| 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) | 3.28 | 8.03 | -11.24 | 1 | 4 | 0 | 62 | 301.415 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.28 | 8.52 | -35.49 | 2 | 4 | 1 | 63 | 302.423 | 7 | ↓ |
