In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | Yes |
Popular Name: (2R)-2-amino-N-[(1S)-1-(2-chlorophenyl)ethyl]-N,3-dimethyl-butanamide (2R)-2-amino-N-[(1S)-1-(2-chloro…
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) | 2.24 | 5.69 | -39.04 | 3 | 3 | 1 | 48 | 269.796 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.24 | 5.35 | -7.77 | 2 | 3 | 0 | 46 | 268.788 | 4 | ↓ |