| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 18 | Yes |
Popular Name: MFCD09972006 MFCD09972006
Find On: PubMed — Wikipedia — Google
CAS Number: 1017791-17-1
| 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) | 3.09 | 8.24 | -47.09 | 3 | 2 | 1 | 32 | 237.326 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.09 | 6.82 | -7.55 | 2 | 2 | 0 | 28 | 236.318 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
