In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2007 | 27 | No |
Popular Name: 2-amino-3-[diphenyl-(p-tolyl)methyl]sulfanyl-propanoic 2-amino-3-[diphenyl-(p-tolyl)met…
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) | 2.78 | -0.6 | -37.52 | 3 | 3 | 0 | 67 | 377.509 | 7 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
KIF11-2-E | Kinesin-like Protein 1 (cluster #2 Of 2), Eukaryotic | Eukaryotes | 62 | 0.37 | Binding ≤ 10μM |
Z81247-2-O | HeLa (Cervical Adenocarcinoma Cells) (cluster #2 Of 9), Other | Other | 330 | 0.34 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
KIF11_HUMAN | P52732 | Kinesin-like Protein 1, Human | 61.7 | 0.37 | Binding ≤ 1μM |
KIF11_HUMAN | P52732 | Kinesin-like Protein 1, Human | 61.7 | 0.37 | Binding ≤ 10μM |
Z81247 | Z81247 | HeLa (Cervical Adenocarcinoma Cells) | 210 | 0.35 | Functional ≤ 10μM |
Description | Species |
---|---|
Kinesins | |
MHC class II antigen presentation |