In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 35 | Yes |
Popular Name: (4S)-4-[1-[2-(2-allylphenoxy)ethyl]benzimidazol-2-yl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one (4S)-4-[1-[2-(2-allylphenoxy)eth…
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) | 5.47 | 15.85 | -13.69 | 0 | 5 | 0 | 47 | 465.597 | 9 | ↓ |
Mid Mid (pH 6-8) | 5.47 | 16.35 | -42.21 | 1 | 5 | 1 | 49 | 466.605 | 9 | ↓ |