In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 14th, 2009 | 23 | Yes |
Popular Name: 4-iodo-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]benzamide 4-iodo-N-[6-(3-oxopiperazin-1-yl…
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) | 2.75 | 3.67 | -16.68 | 2 | 6 | 0 | 74 | 422.226 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.75 | 4.12 | -49.52 | 3 | 6 | 1 | 76 | 423.234 | 3 | ↓ |