| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2008 | 20 | No |
Popular Name: 1-methyl-1H-indole-2,3-dione 3-[N-(4-fluorophenyl)hydrazone] 1-methyl-1H-indole-2,3-dione 3-[…
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CAS Number: 320422-06-8
| 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) | 4.42 | 4.98 | -8.6 | 1 | 4 | 0 | 50 | 269.279 | 2 | ↓ |
| Ref Reference (pH 7) | 3.23 | 7.48 | -11.94 | 1 | 4 | 0 | 46 | 269.279 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.42 | 6.37 | -46.17 | 0 | 4 | -1 | 53 | 268.271 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.42 | 5.11 | -44.59 | 0 | 4 | -1 | 53 | 268.271 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 163 - 165 | KeyOrganics |
