In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 20 | Yes |
Popular Name: (S)-1,3-benzodioxol-5-yl-(2-fluoro-4-methoxy-phenyl)methanamine (S)-1,3-benzodioxol-5-yl-(2-fluo…
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) | 2.94 | 4.32 | -59.62 | 3 | 4 | 1 | 55 | 276.287 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.94 | 4 | -9.81 | 2 | 4 | 0 | 54 | 275.279 | 3 | ↓ |