| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2005 | 27 | No |
Popular Name: TNP-470 TNP-470
| 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) | 2.72 | -0.84 | -18.21 | 1 | 7 | 0 | 89 | 401.887 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 2.34e-02 g/l | DrugBank-experimental |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| AMPM2-1-E | Methionine Aminopeptidase 2 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 1050 | 0.31 | Binding ≤ 10μM |
| Z100729-1-O | AEC (Aortic Endothelial Cells) (cluster #1 Of 1), Other | Other | 0 | 0.00 | Functional ≤ 10μM |
| Z80852-1-O | A-431 (Epidermoid Carcinoma Cells) (cluster #1 Of 3), Other | Other | 5300 | 0.27 | Functional ≤ 10μM |
| Z81020-2-O | HepG2 (Hepatoblastoma Cells) (cluster #2 Of 8), Other | Other | 860 | 0.31 | Functional ≤ 10μM |
| Z81057-2-O | HUVEC (Umbilical Vein Endothelial Cells) (cluster #2 Of 4), Other | Other | 500 | 0.33 | Functional ≤ 10μM |
| Z81247-3-O | HeLa (Cervical Adenocarcinoma Cells) (cluster #3 Of 9), Other | Other | 2020 | 0.30 | Functional ≤ 10μM |
| Z81057-5-O | HUVEC (Umbilical Vein Endothelial Cells) (cluster #5 Of 5), Other | Other | 1 | 0.47 | ADME/T ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| AMPM2_HUMAN | P50579 | Methionine Aminopeptidase 2, Human | 1 | 0.47 | Binding ≤ 1μM |
| AMPM2_HUMAN | P50579 | Methionine Aminopeptidase 2, Human | 1 | 0.47 | Binding ≤ 10μM |
| Z80852 | Z80852 | A-431 (Epidermoid Carcinoma Cells) | 5300 | 0.27 | Functional ≤ 10μM |
| Z100729 | Z100729 | AEC (Aortic Endothelial Cells) | 0.1 | 0.52 | Functional ≤ 10μM |
| Z81247 | Z81247 | HeLa (Cervical Adenocarcinoma Cells) | 2020 | 0.30 | Functional ≤ 10μM |
| Z81020 | Z81020 | HepG2 (Hepatoblastoma Cells) | 860 | 0.31 | Functional ≤ 10μM |
| Z81057 | Z81057 | HUVEC (Umbilical Vein Endothelial Cells) | 1000 | 0.31 | Functional ≤ 10μM |
| Z81057 | Z81057 | HUVEC (Umbilical Vein Endothelial Cells) | 0.76 | 0.47 | ADME/T ≤ 10μM |
| Description | Species |
|---|---|
| Inactivation, recovery and regulation of the phototransduction cascade |
