In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 29 | Yes |
Popular Name: 4-[(2,3-dioxo-1H-pyrido[3,2-e]pyrazin-4-yl)methyl]-N-[2-(2-thienyl)ethyl]benzamide 4-[(2,3-dioxo-1H-pyrido[3,2-e]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) | 1.84 | 8.68 | -25.88 | 2 | 7 | 0 | 97 | 406.467 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.75 | 7.63 | -55 | 1 | 7 | -1 | 100 | 405.459 | 6 | ↓ |