In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2009 | 18 | Yes |
Popular Name: (2S)-1-(1,3-benzodioxol-5-yloxy)-3-(isopropylamino)propan-2-ol (2S)-1-(1,3-benzodioxol-5-yloxy)…
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) | 1.70 | 1.9 | -42.25 | 3 | 5 | 1 | 65 | 254.306 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.70 | 0.6 | -6.89 | 2 | 5 | 0 | 60 | 253.298 | 6 | ↓ |