In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 15 | Yes |
Popular Name: (1R)-1-[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]ethanamine (1R)-1-[3-fluoro-4-(1,2,4-triazo…
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) | -1.10 | 5.88 | -63.33 | 3 | 4 | 1 | 58 | 207.232 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.10 | 5.6 | -10.31 | 2 | 4 | 0 | 57 | 206.224 | 2 | ↓ |