| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2004 | 12 | Yes |
Popular Name: 1-methyl-1H-indole-3-carbonitrile 1-methyl-1H-indole-3-carbonitrile
Find On: PubMed — Wikipedia — Google
CAS Number: 24662-37-1
| 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) | 1.91 | 6.69 | -9.25 | 0 | 2 | 0 | 29 | 156.188 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 55-56? | Alfa-Aesar |
| Melting_Point | 55-56° | Alfa-Aesar |
| Purity | 95% | Fluorochem |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| IMDH2-2-E | Inosine-5'-monophosphate Dehydrogenase 2 (cluster #2 Of 2), Eukaryotic | Eukaryotes | 7660 | 0.60 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| IMDH2_HUMAN | P12268 | Inosine-5'-monophosphate Dehydrogenase 2, Human | 7660 | 0.60 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Purine ribonucleoside monophosphate biosynthesis |
