In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | Yes |
Popular Name: (2S)-2-amino-3-methyl-1-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butan-1-one (2S)-2-amino-3-methyl-1-(4-pheny…
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) | 1.64 | 6.72 | -43.69 | 3 | 3 | 1 | 48 | 259.373 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.64 | 6.41 | -6.69 | 2 | 3 | 0 | 46 | 258.365 | 3 | ↓ |