| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 8th, 2008 | 10 | Yes |
Popular Name: 2,4-Pyrimidinediamine, 5-ethyl- (9CI) 2,4-Pyrimidinediamine, 5-ethyl- …
Find On: PubMed — Wikipedia — Google
CAS Number: 73119-06-9
| 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) | 0.32 | 2.17 | -6 | 4 | 4 | 0 | 78 | 138.174 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.32 | -1.24 | -26.65 | 5 | 4 | 1 | 79 | 139.182 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.32 | 2.48 | -28.28 | 5 | 4 | 1 | 79 | 139.182 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5328914 | IBM Patent Data |
