| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2005 | 11 | Yes |
Popular Name: (4-Pyridylthio)acetic acid (4-Pyridylthio)acetic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 10351-19-6 , 84468-14-4 , [10351-19-6]
"(4-Pyridylthio)acetic acid, 98%"
(4-Pyridylthio)acetic acid, 98%
(pyridin-4-ylsulfanyl)acetic acid
2-(pyridin-4-ylsulfanyl)acetic acid
2-(Pyridin-4-ylthio)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) | 0.33 | 3.61 | -43.29 | 0 | 3 | -1 | 53 | 168.197 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.33 | 3.91 | -58.91 | 1 | 3 | 0 | 54 | 169.205 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 251 - 255 | Enamine Building Blocks |
| MP | 251...255 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | Fluorochem |
| Melting_Point | ca 260? dec. | Alfa-Aesar |
| Melting_Point | ca 260° dec. | Alfa-Aesar |
No pre-computed analogs available. Try a structural similarity search.