In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 12th, 2008 | 28 | Yes |
Popular Name: 1-[(3R)-1-[(3-butyl-2-isohexylsulfonyl-imidazol-4-yl)methyl]-3-piperidyl]ethanone 1-[(3R)-1-[(3-butyl-2-isohexylsu…
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) | 3.51 | -1.27 | -54.41 | 1 | 6 | 1 | 73 | 412.62 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.51 | -1 | -117.01 | 2 | 6 | 2 | 75 | 413.628 | 11 | ↓ |