| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 14 | Yes |
Popular Name: MFCD04530424 MFCD04530424
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1052514-11-0 , 774191-55-8
N-(3-Pyridinylmethyl)(2-thienyl)methanamine
N-(3-pyridinylmethyl)-N-(2-thienylmethyl)amine
Pyridin-3-ylmethyl-thiophen-2-ylmethyl-amine hydrochloride
Pyridin-3-ylmethyl-thiophen-2-ylmethyl-aminehydrochloride
None
| 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) | 1.56 | 5.62 | -45.38 | 2 | 2 | 1 | 29 | 205.306 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.56 | 5.89 | -105.3 | 3 | 2 | 2 | 31 | 206.314 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
