| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 17 | Yes |
Popular Name: (2S)-2-[[(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]amino]-N-methyl-propanamide (2S)-2-[[(1S)-1-(3-chloro-4-fluo…
| 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) | 2.26 | 4.67 | -45.63 | 3 | 3 | 1 | 46 | 259.732 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.26 | 3.77 | -9.06 | 2 | 3 | 0 | 41 | 258.724 | 4 | ↓ |
