| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 18 | Yes |
Popular Name: MFCD13562639 MFCD13562639
Find On: PubMed — Wikipedia — Google
CAS Number: 1236267-68-7
None
| 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) | 0.46 | 2.56 | -43.28 | 4 | 4 | 1 | 66 | 249.334 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.46 | 2.23 | -9.73 | 3 | 4 | 0 | 64 | 248.326 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
