In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2010 | 19 | Yes |
Popular Name: (1S)-1-(2-chloro-4-fluoro-phenyl)-N-methyl-2-(m-tolyl)ethanamine (1S)-1-(2-chloro-4-fluoro-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) | 4.68 | 9.72 | -41.92 | 2 | 1 | 1 | 17 | 278.778 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.68 | 8.88 | -3.59 | 1 | 1 | 0 | 12 | 277.77 | 4 | ↓ |