In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 19 | Yes |
Popular Name: (1R)-1-(5-fluoro-1,3-benzothiazol-2-yl)-1-phenyl-ethanamine (1R)-1-(5-fluoro-1,3-benzothiazo…
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) | 3.65 | 6.49 | -6.74 | 2 | 2 | 0 | 39 | 272.348 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.65 | 6.75 | -49.56 | 3 | 2 | 1 | 41 | 273.356 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.