| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 16th, 2008 | 29 | Yes |
Popular Name: tylophorine tylophorine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 111408-21-0 , 482-20-2
| 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) | 3.64 | 10.49 | -48.7 | 1 | 5 | 1 | 41 | 394.491 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Target | Mu-type opioid receptor(P35372)&Transcription factor AP-1(P05412)&Intercellular adhesion molecule 1(P05362)&Vascular cell adhesion protein 1(P19320)&Vascular endothelial growth factor A(P15692)&Nuclear receptor subfamily 1 group I member 2(O75469) | Herbal Ingredients Targets |
| PUBCHEM_PATENT_ID | US4816462; US4970212 | IBM Patent Data |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80928-6-O | HCT-116 (Colon Carcinoma Cells) (cluster #6 Of 9), Other | Other | 670 | 0.30 | Functional ≤ 10μM |
| Z81247-2-O | HeLa (Cervical Adenocarcinoma Cells) (cluster #2 Of 9), Other | Other | 3100 | 0.27 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80928 | Z80928 | HCT-116 (Colon Carcinoma Cells) | 670 | 0.30 | Functional ≤ 10μM |
| Z81247 | Z81247 | HeLa (Cervical Adenocarcinoma Cells) | 3100 | 0.27 | Functional ≤ 10μM |
