In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2009 | 16 | Yes |
Popular Name: (2S)-2-amino-N-[(4-fluorophenyl)methyl]-N-methyl-butanamide (2S)-2-amino-N-[(4-fluorophenyl)…
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) | 0.97 | 4.45 | -42.81 | 3 | 3 | 1 | 48 | 225.287 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.97 | 4.15 | -7.49 | 2 | 3 | 0 | 46 | 224.279 | 4 | ↓ |