In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | Yes |
Popular Name: (2S)-2-amino-N-[(2,4-difluorophenyl)methyl]-N-methyl-pentanamide (2S)-2-amino-N-[(2,4-difluorophe…
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) | 1.62 | 5.1 | -42.52 | 3 | 3 | 1 | 48 | 257.304 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.62 | 4.77 | -5.84 | 2 | 3 | 0 | 46 | 256.296 | 5 | ↓ |