In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 23 | Yes |
Popular Name: (1S)-1-[4-(1,3-benzodioxol-5-yloxy)phenyl]-2-(cyclopropylamino)ethanol (1S)-1-[4-(1,3-benzodioxol-5-ylo…
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) | 2.92 | 5.25 | -50.12 | 3 | 5 | 1 | 65 | 314.361 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.92 | 3.9 | -8.17 | 2 | 5 | 0 | 60 | 313.353 | 6 | ↓ |