In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 4th, 2008 | 32 | Yes |
Popular Name: 3,4,5-triethoxy-N-[6-(4-ethylpiperazin-1-yl)-3-pyridyl]benzamide 3,4,5-triethoxy-N-[6-(4-ethylpip…
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) | 3.23 | 10.81 | -45.62 | 2 | 8 | 1 | 77 | 443.568 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.23 | 8.59 | -12.19 | 1 | 8 | 0 | 76 | 442.56 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.23 | 11.15 | -105.29 | 3 | 8 | 2 | 79 | 444.576 | 10 | ↓ |