| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 28th, 2010 | 28 | No |
Popular Name: [(2S,3R,4S,5S)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl [(2S,3R,4S,5S)-5-(2-amino-6-oxo-…
| 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) | -3.69 | -3.08 | -259.55 | 5 | 16 | -3 | 261 | 440.178 | 6 | ↓ |
| Mid Mid (pH 6-8) | -3.69 | -4.23 | -138.84 | 6 | 16 | -2 | 258 | 441.186 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| CDC42-1-E | Cell Division Control Protein 42 Homolog (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1400 | 0.29 | Binding ≤ 10μM |
| RAC1-1-E | Ras-related C3 Botulinum Toxin Substrate 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 2700 | 0.28 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| CDC42_HUMAN | P60953 | Cell Division Control Protein 42 Homolog, Human | 1400 | 0.29 | Binding ≤ 10μM |
| RAC1_HUMAN | P63000 | Ras-related C3 Botulinum Toxin Substrate 1, Human | 2700 | 0.28 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Activation of Rac | |
| CD28 dependent Vav1 pathway | |
| CDO in myogenesis | |
| DAP12 signaling | |
| DCC mediated attractive signaling | |
| DSCAM interactions | |
| EGFR downregulation | |
| EPH-ephrin mediated repulsion of cells | |
| EPHB-mediated forward signaling | |
| Ephrin signaling | |
| Factors involved in megakaryocyte development and platelet production | |
| FCERI mediated MAPK activation | |
| G alpha (12/13) signalling events | |
| GPVI-mediated activation cascade | |
| Inactivation of Cdc42 and Rac | |
| Nef and signal transduction | |
| NRAGE signals death through JNK | |
| PCP/CE pathway | |
| Regulation of actin dynamics for phagocytic cup formation | |
| Rho GTPase cycle | |
| Sema3A PAK dependent Axon repulsion | |
| SEMA3A-Plexin repulsion signaling by inhibiting Integrin adhesion | |
| Sema4D induced cell migration and growth-cone collapse | |
| Sema4D mediated inhibition of cell attachment and migration | |
| Signal transduction by L1 | |
| Signaling by SCF-KIT | |
| Translocation of GLUT4 to the plasma membrane | |
| VEGFA-VEGFR2 Pathway | |
| VEGFR2 mediated vascular permeability |
