In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 18 | Yes |
Popular Name: (2,3-Dihydro-benzo[1,4]dioxin-6-yl)-pyridin-4-ylmethyl-amine (2,3-Dihydro-benzo[1,4]dioxin-6-…
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CAS Number: 774553-49-0
DIHYDROBENZODIOXINYLPYRIDINYLMETHYLAMIN
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-pyridinylmethyl)amine
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) | 1.41 | 4.47 | -7.96 | 1 | 4 | 0 | 43 | 242.278 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.41 | 4.93 | -39.55 | 2 | 4 | 1 | 45 | 243.286 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |