| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 19 | Yes |
Popular Name: 4-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)butanoic acid 4-(1,3-dimethyl-2,6-dioxo-1,2,3,…
Find On: PubMed — Wikipedia — Google
CAS Number: 52083-48-4
| 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) | -0.15 | 0.62 | -55.03 | 0 | 8 | -1 | 101 | 265.249 | 4 | ↓ |
| Mid Mid (pH 6-8) | -3.55 | 0.87 | -75.92 | 1 | 8 | 0 | 103 | 266.257 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 167 - 169 | Enamine Building Blocks |
| MP | 167...169 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
