| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 21st, 2009 | 19 | Yes |
Popular Name: N-[2-(4-chlorophenyl)ethyl]thieno[2,3-e]pyrimidin-4-amine N-[2-(4-chlorophenyl)ethyl]thien…
| 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) | 3.76 | 8.71 | -9.91 | 1 | 3 | 0 | 38 | 289.791 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.76 | 9.14 | -33.42 | 2 | 3 | 1 | 39 | 290.799 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80362-6-O | P388 (Lymphoma Cells) (cluster #6 Of 8), Other | Other | 29 | 0.56 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80362 | Z80362 | P388 (Lymphoma Cells) | 29 | 0.56 | Functional ≤ 10μM |
