| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2011 | 38 | Yes |
Popular Name: 2-[[5-amino-2-[5-[ethyl(methyl)BLAHyl]-2,4-dioxo-pyrimidin-1-yl]pyrimidin-4-yl]amino]acetic 2-[[5-amino-2-[5-[ethyl(methyl)B…
| 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) | 1.18 | 13.09 | -51.91 | 4 | 10 | -1 | 159 | 509.546 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.64 | 10.66 | -119.3 | 3 | 10 | -2 | 162 | 508.538 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -1.11 | 10.7 | -133.67 | 5 | 10 | 0 | 167 | 510.554 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.18 | 13.25 | -124.59 | 6 | 10 | 1 | 162 | 511.562 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
