In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 27 | Yes |
Popular Name: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(6-methoxytetralin-5-yl)oxy-ethanamine N-[[(3R)-2,3-dihydro-1,4-benzodi…
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) | 3.54 | 9.71 | -43.03 | 2 | 5 | 1 | 54 | 370.469 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.54 | 8.31 | -9.72 | 1 | 5 | 0 | 49 | 369.461 | 7 | ↓ |