| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 15 | Yes |
Popular Name: XANTHURENIC ACID XANTHURENIC ACID
"4,8-Dihydroxy-2-quinolinecarboxylic acid, 95%"
4,8-Dihydroxyquinoline-2-carboxylic acid
4,8-Dihydroxyquinoline-2-carboxylic acid, 96%
59-00-7; C02470; Xanthurenate; Xanthurenic 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) | 0.42 | 2.88 | -95.62 | 1 | 5 | -2 | 96 | 203.153 | 1 | ↓ |
| Ref Reference (pH 7) | 0.42 | 2.11 | -45.3 | 2 | 5 | -1 | 93 | 204.161 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | 0.67 | -117.47 | 1 | 5 | -2 | 96 | 203.153 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | 1.44 | -204.77 | 0 | 5 | -3 | 99 | 202.145 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 297 - 298 | Acros Organics |
| Purity | 95% | Fluorochem |
| therap | caspase activator, guanylyl cyclase stimulant | MicroSource Spectrum |
| UniProt Database Links | CDPK4_PLABA; CDPK4_PLAF7; CDPK4_PLAYO | ChEBI |
| Therapy | exflagellation stimulant; apoptosis stimulant | SMDC MicroSource |
| H phrase | H335: May cause respiratory irritation | Acros Organics |
| H phrase | H335: May cause respiratory irritation; H315: Causes skin irritation; H319: Causes serious eye irritation | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water | Acros Organics |
| R phrase | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection. | Acros Organics |
| Hazard | XI: Irritant | Acros Organics |
