In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 18 | Yes |
Popular Name: (1S)-N-[(2-chloro-6-fluoro-phenyl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine (1S)-N-[(2-chloro-6-fluoro-pheny…
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) | 1.83 | 8.06 | -38.8 | 2 | 4 | 1 | 47 | 269.731 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 6.8 | -11.92 | 1 | 4 | 0 | 43 | 268.723 | 4 | ↓ |