In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 30 | Yes |
Popular Name: 1-[(2S)-2-[1-[4-(2,5-dimethylphenoxy)butyl]benzimidazol-2-yl]pyrrolidin-1-yl]ethanone 1-[(2S)-2-[1-[4-(2,5-dimethylphe…
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) | 4.40 | 13.15 | -17.41 | 0 | 5 | 0 | 47 | 405.542 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.40 | 13.55 | -32.84 | 1 | 5 | 1 | 49 | 406.55 | 7 | ↓ |