| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 5th, 2009 | 32 | No |
Popular Name: trimethyl-[2-[tetraoxo-[2-(trimethylammonio)ethyl]BLAHyl]ethyl]ammonium trimethyl-[2-[tetraoxo-[2-(trime…
| 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) | -5.37 | 13.22 | -72.47 | 0 | 8 | 2 | 78 | 438.528 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| TERT-1-E | Telomerase Reverse Transcriptase (cluster #1 Of 2), Eukaryotic | Eukaryotes | 2500 | 0.25 | Binding ≤ 10μM |
| DPO1-2-B | Taq Polymerase 1 (cluster #2 Of 2), Bacterial | Bacteria | 5000 | 0.23 | Binding ≤ 10μM |
| Z80166-2-O | HT-29 (Colon Adenocarcinoma Cells) (cluster #2 Of 2), Other | Other | 3240 | 0.24 | ADME/T ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| DPO1_THEAQ | P19821 | Taq Polymerase 1, Theaq | 5000 | 0.23 | Binding ≤ 10μM |
| TERT_HUMAN | O14746 | Telomerase Reverse Transcriptase, Human | 2500 | 0.25 | Binding ≤ 10μM |
| Z80166 | Z80166 | HT-29 (Colon Adenocarcinoma Cells) | 3240 | 0.24 | ADME/T ≤ 10μM |
| Description | Species |
|---|---|
| formation of the beta-catenin:TCF transactivating complex | |
| Telomere Extension By Telomerase |
