In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2005 | 22 | Yes |
Popular Name: 4-[[1-cyclopentyl-5-(hydroxymethyl)imidazol-2-yl]sulfanylmethyl]benzonitrile 4-[[1-cyclopentyl-5-(hydroxymeth…
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) | 3.24 | 7.85 | -11 | 1 | 4 | 0 | 62 | 313.426 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 8.31 | -35.16 | 2 | 4 | 1 | 63 | 314.434 | 5 | ↓ |