| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2005 | 7 | Yes |
Popular Name: 4-AMINOPYRIDINE 4-AMINOPYRIDINE
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 504-24-5 , [504-24-5]
| 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) | -0.28 | 1.07 | -28.7 | 3 | 2 | 1 | 40 | 95.125 | 0 | ↓ |
| Hi High (pH 8-9.5) | -0.28 | 0.59 | -4.62 | 2 | 2 | 0 | 39 | 94.117 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 155-158° | Oakwood Chemical |
| Mp [°C] | 157 - 161 | Acros Organics |
| M.P | 157 °C | Indofine |
| Melting_Point | 157-161? | Alfa-Aesar |
| Melting_Point | 157-161° | Alfa-Aesar |
| MP | 158 | TCI |
| MP | 160 - 162 | Enamine Building Blocks |
| MP | 160...162 | Enamine Building Blocks |
| ALOGPS_SOLUBILITY | 2.71e+02 g/l | DrugBank-approved |
| BP [°C] | 273 | Acros Organics |
| Boiling_Point | 273-274? | Alfa-Aesar |
| Boiling_Point | 273-274° | Alfa-Aesar |
| BP | 273° | Oakwood Chemical |
| BP | 287 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0741694A1; EP0781266A1; EP0882025A1; US4139537; US4220470; US5780506; US5874467; US5889059; US5965587; US5977399; US5981581; US5990339; US6066756; US6100263; US6127568; WO1995021156A1; WO1996007633A1; WO1997029093A1 | IBM Patent Data |
| Patent Database Links | EP0796849; EP1221444; EP1367053; EP1422218; EP1424327; EP1679059; EP1707200; GB2369117; US2002155065; US2003187007; US2004059120; US2004083560; US2005096331; US2005113368; US2005251932; US2005282853; US2007191366; US2008221086; US2008267912; US2008292582 | ChEBI |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H300: Fatal if swallowed; H311: Toxic in contact with skin; H319: Causes serious eye irritation; H335: May cause respiratory irritation | Acros Organics |
| Therapy | Induces depolarization of GABA neurons; weak non-selective | SMDC Pharmakon |
| therap | K channel blocker; multiple sclerosis therapy | MicroSource Spectrum |
| 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 | R24: Toxic in contact with skin. | Acros Organics |
| R phrase | R24: Toxic in contact with skin.; R28: Very toxic if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| S phrase | S1: Keep locked up. | Acros Organics |
| S phrase | S1: Keep locked up.; S28A: After contact with skin, wash immediately with plenty of water.; 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 (sho | Acros Organics |
| Hazard | T+: Very toxic | Acros Organics |
| PUBCHEM_PATENT_ID | US4486586; US5064954 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.