| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 14 | Yes |
Popular Name: MFCD13562155 MFCD13562155
Find On: PubMed — Wikipedia — Google
CAS Number: 1246172-86-0
| 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) | 1.13 | 4.86 | -36.66 | 2 | 3 | 1 | 37 | 195.286 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.13 | 3.48 | -6.33 | 1 | 3 | 0 | 32 | 194.278 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
