In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 12th, 2008 | 17 | No |
Popular Name: (5Z)-5-[(4-isopropylphenyl)methylene]thiazolidine-2,4-dione (5Z)-5-[(4-isopropylphenyl)methy…
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) | 3.00 | -0.4 | -6.44 | 1 | 3 | 0 | 50 | 247.319 | 2 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
PIM1-1-E | Serine/threonine-protein Kinase PIM1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 40 | 0.61 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
PIM1_HUMAN | P11309 | Serine/threonine-protein Kinase PIM1, Human | 40 | 0.61 | Binding ≤ 1μM |
PIM1_HUMAN | P11309 | Serine/threonine-protein Kinase PIM1, Human | 40 | 0.61 | Binding ≤ 10μM |