| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 33 | Yes |
Popular Name: 5-(3-benzyloxyphenyl)-7-(3-pyrrolidin-1-ylcyclobutyl)pyrrolo[2,3-d]pyrimidin-4-amine 5-(3-benzyloxyphenyl)-7-(3-pyrro…
None
| 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) | 4.39 | 15.42 | -45.28 | 3 | 6 | 1 | 70 | 440.571 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.39 | 13.05 | -9 | 2 | 6 | 0 | 69 | 439.563 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.39 | 15.91 | -90.59 | 4 | 6 | 2 | 72 | 441.579 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| IGF1R-1-E | Insulin-like Growth Factor 1 Receptor (cluster #1 Of 2), Eukaryotic | Eukaryotes | 170 | 0.29 | Binding ≤ 10μM |
| INSR-1-E | Insulin Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 2800 | 0.24 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| IGF1R_HUMAN | P08069 | Insulin-like Growth Factor I Receptor, Human | 170 | 0.29 | Binding ≤ 1μM |
| INSR_HUMAN | P06213 | Insulin Receptor, Human | 2800 | 0.24 | Binding ≤ 10μM |
| IGF1R_HUMAN | P08069 | Insulin-like Growth Factor I Receptor, Human | 170 | 0.29 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Insulin receptor recycling | |
| IRS activation | |
| IRS-related events triggered by IGF1R | |
| SHC activation | |
| SHC-related events triggered by IGF1R | |
| Signal attenuation | |
| Signaling by Insulin receptor | |
| Signaling by Type 1 Insulin-like Growth Factor 1 Receptor (IGF1R) |
