| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 11th, 2011 | 16 | Yes |
Popular Name: MFCD19103269 MFCD19103269
Find On: PubMed — Wikipedia — Google
CAS Number: 1291486-10-6
| 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) | 1.36 | 5.49 | -8.35 | 0 | 4 | 0 | 56 | 216.24 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.36 | 5.95 | -40.59 | 1 | 4 | 1 | 57 | 217.248 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
