| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 6th, 2007 | 7 | No |
Popular Name: 2-Amino-5-methylthiazole 2-Amino-5-methylthiazole
Find On: PubMed — Wikipedia — Google
CAS Numbers: 55502-89-1 , 7305-71-7
"2-Amino-5-methylthiazole, 99%"
2-Amino-5-(methyl-d3)-thiazole
| 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) | 0.70 | 1.58 | -5.16 | 2 | 2 | 0 | 39 | 114.173 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 0.70 | 1.86 | -26.53 | 3 | 2 | 1 | 40 | 115.181 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks |
| Mp [°C] | 93 | Acros Organics |
| MP | 93 - 98 | Enamine Building Blocks |
| MP | 93-98° | Oakwood Chemical |
| MP | 93...98 | Enamine Building Blocks |
| MP | 94 - 96 | Enamine Building Blocks |
| purity | 95 | Enamine Building Blocks |
| Purity | 95+% | Matrix Scientific |
| Melting_Point | 95-98? | Alfa-Aesar |
| Melting_Point | 95-98° | Alfa-Aesar |
| Purity | 98% | Fluorochem |
| Purity | 99% | APIChem |
| H phrase | H373: May cause damage to organs through prolonged or repeated exposure | Acros Organics |
| H phrase | H373: May cause damage to organs through prolonged or repeated exposure; H410: Very toxic to aquatic life with long lasting effects; H302: Harmful if swallowed | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| P phrase | P260: Do not breathe dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P260: Do not breathe dust/fume/gas/mist/vapors/spray; P273: Avoid release to the environment; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful if swallowed.; R48/22: Harmful : danger of serious damage to health by prolonged exposure if swallowed.; R50/53: Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. | Acros Organics |
| S phrase | S29: Do not empty into drains. | Acros Organics |
| S phrase | S29: Do not empty into drains.; S61: Avoid release to the environment. Refer to special instructions / safety data sheets. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
| Hazard | XN: Harmful; N: Dangerous for the environment | Acros Organics |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| NOS1-7-E | Nitric-oxide Synthase, Brain (cluster #7 Of 7), Eukaryotic | Eukaryotes | 1100 | 1.19 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| NOS1_HUMAN | P29475 | Nitric-oxide Synthase, Brain, Human | 1100 | 1.19 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Nitric oxide stimulates guanylate cyclase | |
| Phagosomal maturation (early endosomal stage) |
