| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2005 | 19 | No |
Popular Name: 1-methyl-1H-indole-2,3-dione 3-(phenylhydrazone) 1-methyl-1H-indole-2,3-dione 3-(…
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CAS Number: 15096-16-9
| 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) | 3.07 | 7.54 | -8.99 | 1 | 4 | 0 | 46 | 251.289 | 2 | ↓ |
| Ref Reference (pH 7) | 3.07 | 7.41 | -12.42 | 1 | 4 | 0 | 46 | 251.289 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.25 | 6.3 | -52.13 | 0 | 4 | -1 | 53 | 250.281 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.25 | 5.01 | -49.48 | 0 | 4 | -1 | 53 | 250.281 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 139 - 140 | KeyOrganics |
