| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2011 | 20 | Yes |
Popular Name: (2S)-2-[[(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]amino]-N-isobutyl-propanamide (2S)-2-[[(1S)-1-(3-chloro-4-fluo…
None
None
| 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) | 3.38 | 6.11 | -8.34 | 2 | 3 | 0 | 41 | 300.805 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.38 | 7.02 | -45.76 | 3 | 3 | 1 | 46 | 301.813 | 6 | ↓ |
