| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2008 | 19 | Yes |
Popular Name: MFCD07397464 MFCD07397464
Find On: PubMed — Wikipedia — Google
CAS Number: 887031-26-7
AMINOFLUOROMETHOXYPHENYLTHIAZOLYLACETICACI
[2-Amino-4-(3-fluoro-4-methoxy-phenyl)-thiazol-5-yl]-acetic acid
| 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) | 1.45 | 4.64 | -55.24 | 2 | 5 | -1 | 89 | 281.288 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.96 | 5.15 | -106.65 | 1 | 5 | -2 | 86 | 280.28 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 5.56 | -48.32 | 3 | 5 | 0 | 90 | 282.296 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.