| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 20th, 2008 | 28 | No |
Popular Name: N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-2-ethyl-3-methoxy-benzohydrazide N'-tert-butyl-N'-(3,5-dimethylbe…
| 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) | 4.04 | 11.11 | -11.68 | 1 | 5 | 0 | 59 | 382.504 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ECR-1-E | Ecdysone Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 250 | 0.33 | Functional ≤ 10μM |
| O77240-1-E | Ecdysone Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 410 | 0.32 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ECR_BOMMO | P49881 | Ecdysone Receptor, Bommo | 250 | 0.33 | Functional ≤ 10μM |
| ECR_AEDAE | P49880 | Ecdysone Receptor, Aedae | 440 | 0.32 | Functional ≤ 10μM |
| O77240_CHOFU | O77240 | Ecdysone Receptor, Chofu | 410 | 0.32 | Functional ≤ 10μM |
