In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2008 | 31 | Yes |
Popular Name: 4-[(2,3-dioxo-1H-pyrido[3,2-e]pyrazin-4-yl)methyl]-N-[(4-ethylphenyl)methyl]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) | 2.45 | 10.21 | -22.02 | 2 | 7 | 0 | 97 | 414.465 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.36 | 9.16 | -51.23 | 1 | 7 | -1 | 100 | 413.457 | 6 | ↓ |