| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 8th, 2009 | 17 | No |
Popular Name: (5Z)-5-[(3-hydroxy-5-methoxy-phenyl)methylene]-2-thioxo-thiazolidin-4-one (5Z)-5-[(3-hydroxy-5-methoxy-phe…
| 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) | 1.79 | 0.43 | -46.06 | 1 | 4 | -1 | 65 | 266.323 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.33 | 1.53 | -12.82 | 2 | 4 | 0 | 62 | 267.331 | 2 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PK3CG-2-E | PI3-kinase P110-gamma Subunit (cluster #2 Of 3), Eukaryotic | Eukaryotes | 78 | 0.59 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PK3CG_HUMAN | P48736 | PI3-kinase P110-gamma Subunit, Human | 77.7 | 0.59 | Binding ≤ 1μM |
| PK3CG_HUMAN | P48736 | PI3-kinase P110-gamma Subunit, Human | 77.7 | 0.59 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| G beta:gamma signalling through PI3Kgamma | |
| GPVI-mediated activation cascade | |
| Synthesis of PIPs at the plasma membrane |
