In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | Yes |
Popular Name: (2S)-2-amino-N-ethyl-N-[(3-fluorophenyl)methyl]butanamide (2S)-2-amino-N-ethyl-N-[(3-fluor…
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) | 1.32 | 5.33 | -42.08 | 3 | 3 | 1 | 48 | 239.314 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.32 | 5.03 | -5.69 | 2 | 3 | 0 | 46 | 238.306 | 5 | ↓ |