In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2010 | 16 | Yes |
Popular Name: (1S)-1-(3-fluoro-4-methyl-phenyl)-N-methyl-hexan-1-amine (1S)-1-(3-fluoro-4-methyl-phenyl…
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) | 3.77 | 8.82 | -42.46 | 2 | 1 | 1 | 17 | 224.343 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.77 | 7.72 | -2.35 | 1 | 1 | 0 | 12 | 223.335 | 6 | ↓ |