In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2005 | 21 | Yes |
Popular Name: 3-[5-(hydroxymethyl)-2-[(3-methoxyphenyl)methylsulfanyl]imidazol-1-yl]propanenitrile 3-[5-(hydroxymethyl)-2-[(3-metho…
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) | 1.57 | 5.93 | -13.48 | 1 | 5 | 0 | 71 | 303.387 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.57 | 6.38 | -39.69 | 2 | 5 | 1 | 72 | 304.395 | 7 | ↓ |