| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 11th, 2008 | 14 | No |
Popular Name: (3Z)-1-Ethyl-1H-indole-2,3-dione 3-oxime (3Z)-1-Ethyl-1H-indole-2,3-dione…
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CAS Number: 3922-17-6
| 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) | 1.33 | 3.2 | -9.59 | 0 | 4 | 0 | 50 | 190.202 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 3.83 | -55.58 | 0 | 4 | -1 | 57 | 189.194 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 4.65 | -62.22 | 0 | 4 | -1 | 57 | 189.194 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
