| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 24th, 2011 | 17 | Yes |
Popular Name: 2-(ethoxycarbonyl)-1H-indole-3-carboxylic acid 2-(ethoxycarbonyl)-1H-indole-3-c…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 441800-93-7 , [441800-93-7]
| 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) | 2.11 | 6.88 | -60.76 | 1 | 5 | -1 | 82 | 232.215 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 2.620000000000000e+002 - 2.630000000000000e+002 | KeyOrganics |
| melting_point | 262 - 263 | KeyOrganics |
| MP | 262-263° | Matrix Scientific |
| Purity | 95% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.