In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2010 | 17 | Yes |
Popular Name: (1S)-1-[3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-ethanamine (1S)-1-[3-(3-fluoro-4-methyl-phe…
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) | 2.70 | 4.1 | -43.49 | 2 | 4 | 1 | 56 | 236.27 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 2.81 | -5.97 | 1 | 4 | 0 | 51 | 235.262 | 3 | ↓ |