In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 7th, 2008 | 20 | Yes |
Popular Name: Allyl-[5-bromo-2-(pyridin-3-ylmethoxy)-benzyl]-amine Allyl-[5-bromo-2-(pyridin-3-ylme…
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) | 3.29 | -0.79 | -39.6 | 2 | 3 | 1 | 39 | 334.237 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.29 | -0.68 | -92.99 | 3 | 3 | 2 | 40 | 335.245 | 7 | ↓ |