| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2005 | 25 | Yes |
Popular Name: 1-(2,6-dichlorophenyl)-4-(trifluoromethyl)[1,2,4]triazolo[4,3-a]quinoxaline 1-(2,6-dichlorophenyl)-4-(triflu…
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CAS Number: 343372-37-2
| 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) | 5.88 | 9.93 | -16.18 | 0 | 4 | 0 | 43 | 383.16 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 173 - 175 | KeyOrganics |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80583-3-O | Vero (Kidney Cells) (cluster #3 Of 3), Other | Other | 10000 | 0.28 | ADME/T ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80583 | Z80583 | Vero (Kidney Cells) | 10000 | 0.28 | ADME/T ≤ 10μM |
