In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 31 | Yes |
Popular Name: N-(2-butyl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)-4-pyrrol-1-yl-benzamide N-(2-butyl-3,4-dihydro-1H-pyrazi…
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) | 3.83 | 11.12 | -21.87 | 1 | 6 | 0 | 55 | 413.525 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.83 | 13.43 | -60.68 | 2 | 6 | 1 | 56 | 414.533 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.83 | 11.53 | -35.17 | 2 | 6 | 1 | 56 | 414.533 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.83 | 13.84 | -115.74 | 3 | 6 | 2 | 58 | 415.541 | 6 | ↓ |