In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 19 | Yes |
Popular Name: 3-[2-(5-amino-1H-benzimidazol-2-yl)ethyl-ethyl-amino]propanenitrile 3-[2-(5-amino-1H-benzimidazol-2-…
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) | 0.63 | 3.51 | -12.68 | 3 | 5 | 0 | 82 | 257.341 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.63 | 5.66 | -54.47 | 4 | 5 | 1 | 83 | 258.349 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.63 | 6.06 | -118.41 | 5 | 5 | 2 | 84 | 259.357 | 6 | ↓ |