In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 31 | Yes |
Popular Name: 4-[3-[1-[3-(2-allylphenoxy)propyl]benzimidazol-2-yl]propyl]morpholine 4-[3-[1-[3-(2-allylphenoxy)propy…
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) | 4.66 | 11.85 | -12.59 | 0 | 5 | 0 | 40 | 419.569 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.66 | 14.11 | -50.51 | 1 | 5 | 1 | 41 | 420.577 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.66 | 12.14 | -34.66 | 1 | 5 | 1 | 41 | 420.577 | 11 | ↓ |
Lo Low (pH 4.5-6) | 4.66 | 14.4 | -101.43 | 2 | 5 | 2 | 42 | 421.585 | 11 | ↓ |