| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2008 | 18 | No |
4,6-dihydro-8-hydroxy-3,4,5-trimethyl-6-oxo-3h-2-benzopyran-7-carboxylicacid
8-hydroxy-3,4,5-trimethyl-6-oxo-4,6-dihydro-3H-isochromene-7-carboxylic 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) | 1.48 | 6.5 | -159.38 | 0 | 5 | -2 | 89 | 248.234 | 1 | ↓ |
| Ref Reference (pH 7) | 1.48 | 6.49 | -157.53 | 0 | 5 | -2 | 89 | 248.234 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.48 | 4.5 | -54.79 | 1 | 5 | -1 | 87 | 249.242 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.48 | 5.79 | -70.13 | 1 | 5 | -1 | 87 | 249.242 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.48 | 4.49 | -53.85 | 1 | 5 | -1 | 87 | 249.242 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| therap | antibacterial | MicroSource Spectrum |
| Therapy | antibiotic | SMDC MicroSource |
| H phrase | H331: Toxic if inhaled | Acros Organics |
| H phrase | H331: Toxic if inhaled; H315: Causes skin irritation; H335: May cause respiratory irritation; H311: Toxic in contact with skin; H319: Causes serious eye irritation; H301: Toxic if swallowed | Acros Organics |
| P phrase | P301 + P310: IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician | Acros Organics |
| P phrase | P301 + P310: IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician; P280: Wear protective gloves/protective clothing/eye protection/face protection; P312: Call a POISON CENTER or doctor/physician if you feel unwell; P302 + P350: IF ON SKIN: G | Acros Organics |
| R phrase | R23/24/25: Toxic by inhalation, in contact with skin and if swallowed. | Acros Organics |
| R phrase | R23/24/25: Toxic by inhalation, in contact with skin and if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| S phrase | S22: Do not breathe dust. | Acros Organics |
| S phrase | S22: Do not breathe dust.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label where possible). | Acros Organics |
| Hazard | T: Toxic | Acros Organics |
