In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 18 | Yes |
Popular Name: (2S)-N-[3-[[acetyl(methyl)amino]methyl]phenyl]-2-amino-propanamide (2S)-N-[3-[[acetyl(methyl)amino]…
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) | -0.54 | 2.69 | -54.66 | 4 | 5 | 1 | 77 | 250.322 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.54 | 2.37 | -15.82 | 3 | 5 | 0 | 75 | 249.314 | 4 | ↓ |