In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2008 | 17 | No |
Popular Name: (2-Amino-4-(4-fluorophenyl)-1,3-thiazol-5-yl)acetic acid (2-Amino-4-(4-fluorophenyl)-1,3-…
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CAS Numbers: 775519-63-6 , [775519-63-6]
2-(2-Amino-4-(4-fluorophenyl)thiazol-5-yl)acetic acid
5-thiazoleacetic acid, 2-amino-4-(4-fluorophenyl)-
AMINOFLUOROPHENYLTHIAZOLYLACETICACI
[2-Amino-4-(4-fluoro-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) | 1.98 | 5.79 | -47.55 | 2 | 4 | -1 | 79 | 251.262 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.98 | 5.85 | -98.98 | 1 | 4 | -2 | 77 | 250.254 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.98 | 6.25 | -44.38 | 3 | 4 | 0 | 80 | 252.27 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |