In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 30 | Yes |
Popular Name: N-(2-isopropyl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl)-4-pyrrol-1-yl-benzamide N-(2-isopropyl-3,4-dihydro-1H-py…
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) | 3.06 | 10.23 | -21.95 | 1 | 6 | 0 | 55 | 399.498 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.06 | 12.45 | -57.17 | 2 | 6 | 1 | 56 | 400.506 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.06 | 10.63 | -34.49 | 2 | 6 | 1 | 56 | 400.506 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.06 | 12.86 | -109.75 | 3 | 6 | 2 | 58 | 401.514 | 4 | ↓ |