In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 26 | No |
Popular Name: 2-(2,4-dioxohexahydropyrimidin-1-yl)-N-[2-(3-methyl-2-pyridyl)ethyl]benzamide 2-(2,4-dioxohexahydropyrimidin-1…
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) | 1.71 | 5.67 | -19.68 | 2 | 7 | 0 | 91 | 352.394 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.89 | 3.08 | -66.01 | 1 | 7 | -1 | 98 | 351.386 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.71 | 6.05 | -46.39 | 3 | 7 | 1 | 93 | 353.402 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.